Software Modules on the aces Cluster

Software Modules on the aces Cluster

ACES Software Modules FASTER Software Modules Grace Software Modules

(Last Updated: Thu Jul 10 2025)

Name Versions available Description Notes
ABYSS ABySS/2.3.7 Assembly By Short Sequences - a de novo, parallel, paired-end sequence assembler
ACTC ACTC/1.1 ACTC converts independent triangles into triangle strips or fans.
ADIOS2 ADIOS2/2.10.2 The Adaptable Input/Output (I/O) System transports data as groups of self-describing variables and attributes across different media types (such as files, wide-area-networks, and remote direct memory access) using a common application programming interface for all transport modes.
AI-TOOLS-GPU AI-Tools-GPU/20240816 AI Tools from Intel (formerly referred to as the Intel AI Analytics Toolkit) give data scientists, AI developers, and researchers familiar Python tools and frameworks to accelerate end-to-end data science and analytics pipelines on Intel architecture. The components are built using oneAPI libraries for low-level compute optimizations. The AI Tools maximize performance from preprocessing through machine learning, and provides interoperability for efficient model development.
ANICALCULATOR ANIcalculator/1.0 This tool will calculate the bidirectional average nucleotide identity (gANI) and Alignment Fraction (AF) between two genomes. Required input is the full path to the fna file (nucleotide sequence of genes in fasta format) of each query genome. Either the rRNA and tRNA genes can be excluded, or provided in a list with the -ignoreList option. This is necessary as the presence of tRNA and/or rRNA genes in the fna will artificially inflate the ANI.
ANTLR ANTLR/2.7.7-Java-11 ANTLR, ANother Tool for Language Recognition, (formerly PCCTS) is a language tool that provides a framework for constructing recognizers, compilers, and translators from grammatical descriptions containing Java, C#, C++, or Python actions.
AOCC AOCC/4.0.0 AMD Optimized C/C++ & Fortran compilers (AOCC) based on LLVM 13.0
APBS APBS/3.4.1 APBS (Adaptive Poisson-Boltzmann Solver) solves the equations of continuum electrostatics for large biomolecular assemblages.
APR APR/1.7.0 Apache Portable Runtime (APR) libraries.
APR-UTIL APR-util/1.6.1 Apache Portable Runtime (APR) util libraries.
ASE ASE/3.20.1
ASE/3.22.1
ASE is a python package providing an open source Atomic Simulation Environment in the Python scripting language. From version 3.20.1 we also include the ase-ext package, it contains optional reimplementations in C of functions in ASE. ASE uses it automatically when installed.
ATK ATK/2.36.0
ATK/2.38.0
ATK provides the set of accessibility interfaces that are implemented by other toolkits and applications. Using the ATK interfaces, accessibility tools have full access to view and control running applications.
AUGUSTUS AUGUSTUS/3.5.0 AUGUSTUS is a program that predicts genes in eukaryotic genomic sequences
ABSEIL Abseil/20230125.2
Abseil/20230125.3
Abseil/20230802.1
Abseil/20240116.1
Abseil is an open-source collection of C++ library code designed to augment the C++ standard library. The Abseil library code is collected from Google's own C++ code base, has been extensively tested and used in production, and is the same code we depend on in our daily coding lives.
ALPHAFOLD AlphaFold/2.3.2-CUDA-11.8.0 AlphaFold can predict protein structures with atomic accuracy even where no similar structure is known
ALPHAFOLD3 AlphaFold3/3.0.1 This module provides details on creating an AlphaFold3 jobscript. Run the following command to see how to create an AlphaFold3 jobscript: alphafold3jobscript --help .
ALPHAPICKLE AlphaPickle/1.4.1 ALPHAPICKLE is a programme for extracting the outputs of DeepMind's ALPHAFOLD protein prediction algorithm from the pickle (.pkl) file output.
ALPHAPULLDOWN AlphaPulldown/2.0.0b5-CUDA-11.7.0 AlphaPulldown is a Python package that streamlines protein-protein interaction screens and high-throughput modelling of higher-order oligomers using AlphaFold-Multimer
AMBER Amber/24-NCCL-2.20.5-CUDA-12.4.1 AmberTools consists of several independently developed packages that work well by themselves, and with Amber itself. The suite can also be used to carry out complete molecular dynamics simulations, with either explicit water or generalized Born solvent models.
AMBERTOOLS AmberTools/22.3 AmberTools consists of several independently developed packages that work well by themselves, and with Amber itself. The suite can also be used to carry out complete molecular dynamics simulations, with either explicit water or generalized Born solvent models.
ANACONDA3 Anaconda3/2021.11
Anaconda3/2022.05
Anaconda3/2022.10
Anaconda3/2023.03-1
Anaconda3/2023.07-2
Anaconda3/2024.02-1
Built to complement the rich, open source Python community, the Anaconda platform provides an enterprise-ready data analytics platform that empowers companies to adopt a modern open data science analytics architecture.
ARMADILLO Armadillo/11.4.3
Armadillo/12.6.2
Armadillo/12.8.0
Armadillo is an open-source C++ linear algebra library (matrix maths) aiming towards a good balance between speed and ease of use. Integer, floating point and complex numbers are supported, as well as a subset of trigonometric and statistics functions.
ARROW Arrow/8.0.0
Arrow/11.0.0
Arrow/14.0.1
Arrow/16.1.0
Apache Arrow (incl. PyArrow Python bindings), a cross-language development platform for in-memory data.
AUTOCONF Autoconf/2.69
Autoconf/2.71
Autoconf/2.72
Autoconf is an extensible package of M4 macros that produce shell scripts to automatically configure software source code packages. These scripts can adapt the packages to many kinds of UNIX-like systems without manual user intervention. Autoconf creates a configuration script for a package from a template file that lists the operating system features that the package can use, in the form of M4 macro calls.
AUTOMAKE Automake/1.16.2
Automake/1.16.3
Automake/1.16.4
Automake/1.16.5
Automake: GNU Standards-compliant Makefile generator
AUTOTOOLS Autotools/20200321
Autotools/20210128
Autotools/20210726
Autotools/20220317
Autotools/20231222
This bundle collect the standard GNU build tools: Autoconf, Automake and libtool
BBMAP BBMap/38.90
BBMap/39.01
BBMap short read aligner, and other bioinformatic tools.
BCFTOOLS BCFtools/1.17
BCFtools/1.19
Samtools is a suite of programs for interacting with high-throughput sequencing data. BCFtools - Reading/writing BCF2/VCF/gVCF files and calling/filtering/summarising SNP and short indel sequence variants
BEDTOOLS BEDTools/2.31.0 BEDTools: a powerful toolset for genome arithmetic. The BEDTools utilities allow one to address common genomics tasks such as finding feature overlaps and computing coverage. The utilities are largely based on four widely-used file formats: BED, GFF/GTF, VCF, and SAM/BAM.
BLAST+ BLAST+/2.12.0
BLAST+/2.13.0
BLAST+/2.14.0
BLAST+/2.14.1
Basic Local Alignment Search Tool, or BLAST, is an algorithm for comparing primary biological sequence information, such as the amino-acid sequences of different proteins or the nucleotides of DNA sequences.
BLAT BLAT/3.7 BLAT on DNA is designed to quickly find sequences of 95% and greater similarity of length 25 bases or more.
BLIS BLIS/0.8.1
BLIS/0.9.0
BLIS/1.0
BLIS is a portable software framework for instantiating high-performance BLAS-like dense linear algebra libraries.
BSBOLT BSBolt/1.6.0 A fast and safe bisulfite sequencing analysis platform BiSuflite Bolt (BSBolt); a fast and scalable bisulfite sequencing analysis platform. BSBolt is an integrated analysis platform that offers support for bisulfite sequencing read simulation, alignment, methylation calling, data aggregation, and data imputation. BSBolt has been validated to work with a wide array of bisulfite sequencing data,including whole genome bisulfite sequencing (WGBS), reduced representative bisulfite sequencing data (RRBS), and targeted methylation sequencing data. BSBolt utilizes forked versions of BWA and WGSIM for read alignment and read simulation respectively. BSBolt is released under the MIT license.
BUSCO BUSCO/5.4.7 BUSCO: assessing genome assembly and annotation completeness with single-copy orthologs
BWA BWA/0.7.17
BWA/0.7.18
Burrows-Wheeler Aligner (BWA) is an efficient program that aligns relatively short nucleotide sequences against a long reference sequence such as the human genome.
BAMTOOLS BamTools/2.5.2 BamTools provides both a programmer's API and an end-user's toolkit for handling BAM files.
BAZEL Bazel/3.7.2
Bazel/4.2.2
Bazel/5.1.1
Bazel/6.3.1
Bazel/7.4.1
Bazel is a build tool that builds code quickly and reliably. It is used to build the majority of Google's software.
BEAUTIFULSOUP BeautifulSoup/4.10.0
BeautifulSoup/4.11.1
BeautifulSoup/4.12.2
Beautiful Soup is a Python library designed for quick turnaround projects like screen-scraping.
BIO-SEARCHIO-HMMER Bio-SearchIO-hmmer/1.7.3 Code to parse output from hmmsearch, hmmscan, phmmer and nhmmer, compatible with both version 2 and version 3 of the HMMER package from http://hmmer.org.
BIOPERL BioPerl/1.7.8 Bioperl is the product of a community effort to produce Perl code which is useful in biology. Examples include Sequence objects, Alignment objects and database searching objects.
BIOPYTHON Biopython/1.79
Biopython/1.81
Biopython/1.82
Biopython/1.83
Biopython/1.84
Biopython is a set of freely available tools for biological computation written in Python by an international team of developers. It is a distributed collaborative effort to develop Python libraries and applications which address the needs of current and future work in bioinformatics.
BISON Bison/3.0.5
Bison/3.3.2
Bison/3.7.1
Bison/3.7.6
Bison/3.8.2
Bison is a general-purpose parser generator that converts an annotated context-free grammar into a deterministic LR or generalized LR (GLR) parser employing LALR(1) parser tables.
BLENDER Blender/3.5.0-linux-x86_64-CUDA-11.7.0 Blender is the free and open source 3D creation suite. It supports the entirety of the 3D pipeline-modeling, rigging, animation, simulation, rendering, compositing and motion tracking, even video editing and game creation.
BLOSC Blosc/1.21.5 Blosc, an extremely fast, multi-threaded, meta-compressor library
BLOSC2 Blosc2/2.4.3
Blosc2/2.13.2
Blosc, an extremely fast, multi-threaded, meta-compressor library
BOOST Boost/1.76.0
Boost/1.77.0
Boost/1.79.0
Boost/1.81.0
Boost/1.82.0
Boost/1.83.0
Boost/1.85.0
Boost provides free peer-reviewed portable C++ source libraries.
BOOST.MPI Boost.MPI/1.79.0 Boost provides free peer-reviewed portable C++ source libraries.
BOOST.PYTHON Boost.Python/1.79.0
Boost.Python/1.81.0
Boost.Python/1.83.0
Boost.Python is a C++ library which enables seamless interoperability between C++ and the Python programming language.
BOWTIE Bowtie/1.3.1 Bowtie is an ultrafast, memory-efficient short read aligner. It aligns short DNA sequences (reads) to the human genome.
BOWTIE2 Bowtie2/2.4.4
Bowtie2/2.4.5
Bowtie 2 is an ultrafast and memory-efficient tool for aligning sequencing reads to long reference sequences. It is particularly good at aligning reads of about 50 up to 100s or 1,000s of characters, and particularly good at aligning to relatively long (e.g. mammalian) genomes. Bowtie 2 indexes the genome with an FM Index to keep its memory footprint small: for the human genome, its memory footprint is typically around 3.2 GB. Bowtie 2 supports gapped, local, and paired-end alignment modes.
BROTLI Brotli/1.0.9
Brotli/1.1.0
Brotli is a generic-purpose lossless compression algorithm that compresses data using a combination of a modern variant of the LZ77 algorithm, Huffman coding and 2nd order context modeling, with a compression ratio comparable to the best currently available general-purpose compression methods. It is similar in speed with deflate but offers more dense compression. The specification of the Brotli Compressed Data Format is defined in RFC 7932.
BROTLI-PYTHON Brotli-python/1.0.9 Brotli is a generic-purpose lossless compression algorithm that compresses data using a combination of a modern variant of the LZ77 algorithm, Huffman coding and 2nd order context modeling, with a compression ratio comparable to the best currently available general-purpose compression methods. It is similar in speed with deflate but offers more dense compression. The specification of the Brotli Compressed Data Format is defined in RFC 7932.
BRUNSLI Brunsli/0.1 Brunsli is a lossless JPEG repacking library.
CATCH CATCH/1.5.2 CATCH is a Python package for designing probe sets to use for nucleic acid capture of diverse sequence.
CD-HIT CD-HIT/4.8.1 CD-HIT is a very widely used program for clustering and comparing protein or nucleotide sequences.
CDO CDO/2.0.5 CDO is a collection of command line Operators to manipulate and analyse Climate and NWP model Data.
CESM-DEPS CESM-deps/2 CESM is a fully-coupled, community, global climate model that provides state-of-the-art computer simulations of the Earth's past, present, and future climate states.
CFITSIO CFITSIO/4.2.0
CFITSIO/4.3.0
CFITSIO/4.3.1
CFITSIO/4.4.1
CFITSIO is a library of C and Fortran subroutines for reading and writing data files in FITS (Flexible Image Transport System) data format.
CGAL CGAL/4.14.3
CGAL/5.5.2
CGAL/5.6
CGAL/5.6.1
The goal of the CGAL Open Source Project is to provide easy access to efficient and reliable geometric algorithms in the form of a C++ library.
CGNS CGNS/4.4.0 The CGNS system is designed to facilitate the exchange of data between sites and applications, and to help stabilize the archiving of aerodynamic data.
CLHEP CLHEP/2.4.6.2 The CLHEP project is intended to be a set of HEP-specific foundation and utility classes such as random generators, physics vectors, geometry and linear algebra. CLHEP is structured in a set of packages independent of any external package.
CLIP CLIP/20230220-CUDA-11.7.0 CLIP (Contrastive Language-Image Pre-Training) is a neural network trained on a variety of (image, text) pairs. It can be instructed in natural language to predict the most relevant text snippet, given an image, without directly optimizing for the task, similarly to the zero-shot capabilities of GPT-2 and 3.
CMAKE CMake/3.12.1
CMake/3.18.4
CMake/3.20.1
CMake/3.21.1
CMake/3.22.1
CMake/3.23.1
CMake/3.24.3
CMake/3.26.3
CMake/3.27.6
CMake/3.29.3
CMake, the cross-platform, open-source build system. CMake is a family of tools designed to build, test and package software.
CP2K CP2K/9.1-lib
CP2K/9.1
CP2K/2022.1-lib
CP2K/2022.1
CP2K/2023.1-CUDA-11.8.0
CP2K/2023.1-lib
CP2K/2023.1-PLUMED-2.9.0
CP2K/2023.1
CP2K is a freely available (GPL) program, written in Fortran 95, to perform atomistic and molecular simulations of solid state, liquid, molecular and biological systems. It provides a general framework for different methods such as e.g. density functional theory (DFT) using a mixed Gaussian and plane waves approach (GPW), and classical pair and many-body potentials.
CUDA CUDA/11.1.1
CUDA/11.3.1
CUDA/11.4.1
CUDA/11.7.0
CUDA/11.8.0
CUDA/12.0.0
CUDA/12.1.0
CUDA/12.1.1
CUDA/12.2.0
CUDA/12.2.2
CUDA/12.3.0
CUDA/12.3.2
CUDA/12.4.0
CUDA/12.4.1
CUDA/12.5.0
CUDA/12.6.0
CUDA/12.8.0
CUDA (formerly Compute Unified Device Architecture) is a parallel computing platform and programming model created by NVIDIA and implemented by the graphics processing units (GPUs) that they produce. CUDA gives developers access to the virtual instruction set and memory of the parallel computational elements in CUDA GPUs.
CUDA-PYTHON CUDA-Python/12.1.0-CUDA-12.1.1 Python bindings for CUDA
CUDA-SAMPLES CUDA-Samples/12.1-CUDA-12.1.1 Samples for CUDA Developers which demonstrates features in CUDA Toolkit
CUDACORE CUDAcore/11.1.1 CUDA (formerly Compute Unified Device Architecture) is a parallel computing platform and programming model created by NVIDIA and implemented by the graphics processing units (GPUs) that they produce. CUDA gives developers access to the virtual instruction set and memory of the parallel computational elements in CUDA GPUs.
CUTLASS CUTLASS/2.11.0-CUDA-11.7.0
CUTLASS/3.4.0-CUDA-12.1.1
CUTLASS is a collection of CUDA C++ template abstractions for implementing high-performance matrix-matrix multiplication (GEMM) and related computations at all levels and scales within CUDA. It incorporates strategies for hierarchical decomposition and data movement similar to those used to implement cuBLAS and cuDNN. CUTLASS decomposes these "moving parts" into reusable, modular software components abstracted by C++ template classes. Primitives for different levels of a conceptual parallelization hierarchy can be specialized and tuned via custom tiling sizes, data types, and other algorithmic policy. The resulting flexibility simplifies their use as building blocks within custom kernels and applications.
CUNIT CUnit/2.1-3 Automated testing framework for C.
CAPNPROTO CapnProto/0.10.2 Cap’n Proto is an insanely fast data interchange format and capability-based RPC system.
CARTOPY Cartopy/0.20.3
Cartopy/0.22.0
Cartopy is a Python package designed to make drawing maps for data analysis and visualisation easy.
CATCH2 Catch2/2.13.9
Catch2/2.13.10
Catch2/3.4.0
Catch2/3.8.0
A modern, C++-native, header-only, test framework for unit-tests, TDD and BDD - using C++11, C++14, C++17 and later
CEREAL Cereal/1.3.0 cereal is a header-only C++11 serialization library. cereal takes arbitrary data types and reversibly turns them into different representations, such as compact binary encodings, XML, or JSON. cereal was designed to be fast, light-weight, and easy to extend - it has no external dependencies and can be easily bundled with other code or used standalone.
CHAMELEON Chameleon/1.2.0 Chameleon is a framework written in C which provides routines to solve dense general systems of linear equations, symmetric positive definite systems of linear equations and linear least squares problems, using LU, Cholesky, QR and LQ factorizations.
CHECK Check/0.15.2 Check is a unit testing framework for C. It features a simple interface for defining unit tests, putting little in the way of the developer. Tests are run in a separate address space, so both assertion failures and code errors that cause segmentation faults or other signals can be caught. Test results are reportable in the following: Subunit, TAP, XML, and a generic logging format.
CHECKM CheckM/1.2.2 CheckM provides a set of tools for assessing the quality of genomes recovered from isolates, single cells, or metagenomes.
CHECKM-DATABASE CheckM-Database/2015_01_16 CheckM provides a set of tools for assessing the quality of genomes recovered from isolates, single cells, or metagenomes. This is the corresponding database.
CHIMERAX ChimeraX/1.3
ChimeraX/1.6.1
ChimeraX/1.7.1
UCSF ChimeraX (or simply ChimeraX) is the next-generation molecular visualization program from the Resource for Biocomputing, Visualization, and Informatics (RBVI), following UCSF Chimera.
CLANG Clang/13.0.1-CUDA-11.7.0
Clang/13.0.1
Clang/15.0.5
Clang/16.0.6-CUDA-12.1.1
Clang/16.0.6
Clang/17.0.6
Clang/18.1.8
C, C++, Objective-C compiler, based on LLVM. Does not include C++ standard library -- use libstdc++ from GCC.
CLIMETLAB CliMetLab/0.12.6 CliMetLab is a Python package aiming at simplifying access to climate and meteorological datasets, allowing users to focus on science instead of technical issues such as data access and data formats. It is mostly intended to be used in Jupyter notebooks, and be interoperable with all popular data analytic packages, such as Numpy, Pandas, Xarray, SciPy, Matplotlib, etc. as well as machine learning frameworks, such as Tensorflow, Keras or PyTorch.
COLABFOLD ColabFold/1.5.2-CUDA-11.7.0 Making protein folding accessible to all. Predict proteins structures both in google colab and on your machine.
COORDGENLIBS CoordgenLibs/3.0.1
CoordgenLibs/3.0.2
Schrodinger-developed 2D Coordinate Generation
CPPUNIT CppUnit/1.15.1 CppUnit is the C++ port of the famous JUnit framework for unit testing.
CRYOSPARC CryoSPARC/4.2.1
CryoSPARC/4.7.0
CryoSPARC/4.7.1
CryoSPARC combines powerful innovations in 3D reconstruction algorithms with specially designed software to provide a streamlined end-to-end single particle cryo-EM workflow.
CUPY CuPy/11.4.0-CUDA-11.4.1 CuPy is an open-source array library accelerated with NVIDIA CUDA.
CUBEGUI CubeGUI/4.8.2 Cube, which is used as performance report explorer for Scalasca and Score-P, is a generic tool for displaying a multi-dimensional performance space consisting of the dimensions (i) performance metric, (ii) call path, and (iii) system resource. Each dimension can be represented as a tree, where non-leaf nodes of the tree can be collapsed or expanded to achieve the desired level of granularity. This module provides the Cube graphical report explorer.
CUBELIB CubeLib/4.8.1
CubeLib/4.8.2
Cube, which is used as performance report explorer for Scalasca and Score-P, is a generic tool for displaying a multi-dimensional performance space consisting of the dimensions (i) performance metric, (ii) call path, and (iii) system resource. Each dimension can be represented as a tree, where non-leaf nodes of the tree can be collapsed or expanded to achieve the desired level of granularity. This module provides the Cube general purpose C++ library component and command-line tools.
CUBEWRITER CubeWriter/4.8.2 Cube, which is used as performance report explorer for Scalasca and Score-P, is a generic tool for displaying a multi-dimensional performance space consisting of the dimensions (i) performance metric, (ii) call path, and (iii) system resource. Each dimension can be represented as a tree, where non-leaf nodes of the tree can be collapsed or expanded to achieve the desired level of granularity. This module provides the Cube high-performance C writer library component.
CYTHON Cython/0.29.33
Cython/3.0.7
Cython/3.0.10
Cython is an optimising static compiler for both the Python programming language and the extended Cython programming language (based on Pyrex).
DB DB/18.1.40 Berkeley DB enables the development of custom data management solutions, without the overhead traditionally associated with such custom projects.
DBCSR DBCSR/2.5.0
DBCSR/2.6.0
DBCSR stands for Distributed Blocked Compressed Sparse Row. DBCSR is a library designed to efficiently perform sparse matrix-matrix multiplication, among other operations.
DB_FILE DB_File/1.859 Perl5 access to Berkeley DB version 1.x.
DBUS DBus/1.13.18
DBus/1.14.0
DBus/1.15.2
DBus/1.15.4
DBus/1.15.8
D-Bus is a message bus system, a simple way for applications to talk to one another. In addition to interprocess communication, D-Bus helps coordinate process lifecycle; it makes it simple and reliable to code a "single instance" application or daemon, and to launch applications and daemons on demand when their services are needed.
DCMTK DCMTK/3.6.7 DCMTK is a collection of libraries and applications implementing large parts the DICOM standard. It includes software for examining, constructing and converting DICOM image files, handling offline media, sending and receiving images over a network connection, as well as demonstrative image storage and worklist servers.
DIAMOND DIAMOND/2.0.15
DIAMOND/2.1.0
Accelerated BLAST compatible local sequence aligner
DATASPACES DataSpaces/2.2.0 DataSpaces is a distributed framework built on a dynamic set of nodes of a HPC cluster, which implements a virtual shared-space abstraction that can be accessed concurrently by all applications in a coupled simulation workflow.
DATASETS/AISHELL Datasets/AISHELL AISHELL speech corpus dataset
DATASETS/CC3M Datasets/CC3M Conceptual Captions 3 Million (CC3M) dataset for vision-language models
DATASETS/COCO Datasets/COCO COCO 2017 image dataset for detection, segmentation, and captioning tasks
DATASETS/IMAGENET-PYTORCH Datasets/ImageNet-PyTorch ImageNet2012 image classification dataset
DATASETS/IMAGENET-TENSORFLOW Datasets/ImageNet-TensorFlow ImageNet2012 image classification dataset
DATASETS/JODIE Datasets/JODIE ImageNet2012 image classification dataset
DATASETS/QM9 Datasets/QM9 Quantum Machine 9 (QM9) dataset for quantum chemistry and machine learning, containing detailed quantum chemical calculations for a large set of small organic molecules
DELTALAKE DeltaLake/0.15.1 Native Delta Lake Python binding based on delta-rs with Pandas integration. The Delta Lake project aims to unlock the power of the Deltalake for as many users and projects as possible by providing native low-level APIs aimed at developers and integrators, as well as a high-level operations API that lets you query, inspect, and operate your Delta Lake with ease.
DENDROPY DendroPy/4.5.2
DendroPy/5.0.1
A Python library for phylogenetics and phylogenetic computing: reading, writing, simulation, processing and manipulation of phylogenetic trees (phylogenies) and characters.
DESMOND Desmond/2023-4 Desmond is a software package developed at D. E. Shaw Research to perform high-speed molecular dynamics simulations of biological systems. The code uses novel parallel algorithms and numerical techniques to achieve high performance and accuracy on NVIDIA GPUs.
DORADO Dorado/0.5.2-CUDA-11.8.0 Dorado is a high-performance, easy-to-use, open source basecaller for Oxford Nanopore reads.
DOXYGEN Doxygen/1.8.20
Doxygen/1.9.1
Doxygen/1.9.4
Doxygen/1.9.5
Doxygen/1.9.7
Doxygen/1.9.8
Doxygen/1.11.0
Doxygen is a documentation system for C++, C, Java, Objective-C, Python, IDL (Corba and Microsoft flavors), Fortran, VHDL, PHP, C#, and to some extent D.
DRACO Draco/1.5.6 Draco is a library for compressing and decompressing 3D geometric meshes and point clouds. It is intended to improve the storage and transmission of 3D graphics.
ELPA ELPA/2021.05.001
ELPA/2021.11.001
ELPA/2022.05.001-CUDA-11.8.0
ELPA/2022.05.001
ELPA/2023.05.001
ELPA/2023.11.001
ELPA/2024.05.001
Eigenvalue SoLvers for Petaflop-Applications .
ELSI ELSI/2.7.1-PEXSI ELSI provides and enhances scalable, open-source software library solutions for electronic structure calculations in materials science, condensed matter physics, chemistry, and many other fields. ELSI focuses on methods that solve or circumvent eigenvalue problems in electronic structure theory. The ELSI infrastructure should also be useful for other challenging eigenvalue problems.
ESMF ESMF/8.0.1
ESMF/8.1.1
ESMF/8.3.0
ESMF/8.6.1
The Earth System Modeling Framework (ESMF) is a suite of software tools for developing high-performance, multi-component Earth science modeling applications.
EASYBUILD EasyBuild/4.7.1
EasyBuild/4.8.0
EasyBuild/4.8.2
EasyBuild/4.9.0
EasyBuild/4.9.2
EasyBuild/4.9.4
EasyBuild/5.0.0
EasyBuild/5.1.1
EasyBuild is a software build and installation framework written in Python that allows you to install software in a structured, repeatable and robust way.
EASYBUILD-ACES EasyBuild-aces/0 EasyBuild environment variables for building system software in /tmp and installing in /sw/eb on aces.hprc.tamu.edu
EASYBUILD-ACES-SCRATCH EasyBuild-aces-SCRATCH/0 User EasyBuild environment for aces.hprc.tamu.edu in $SCRATCH/eb
EASYBUILD-ACES-MYEB EasyBuild-aces-myeb/0 User EasyBuild environment for aces.hprc.tamu.edu in $SCRATCH/eb
EASYBUILD-ACES-TMP EasyBuild-aces-tmp/0 EasyBuild environment variables for building in /tmp and installing in /sw/eb on aces.hprc.tamu.edu
EIGEN Eigen/3.3.8
Eigen/3.3.9
Eigen/3.4.0
Eigen is a C++ template library for linear algebra: matrices, vectors, numerical solvers, and related algorithms.
EMACS Emacs/27.2
Emacs/28.2
GNU Emacs is an extensible, customizable text editor--and more. At its core is an interpreter for Emacs Lisp, a dialect of the Lisp programming language with extensions to support text editing.
FASTA FASTA/36.3.8i The FASTA programs find regions of local or global (new) similarity between protein or DNA sequences, either by searching Protein or DNA databases, or by identifying local duplications within a sequence.
FFTW FFTW/3.3.8
FFTW/3.3.9
FFTW/3.3.10
FFTW is a C subroutine library for computing the discrete Fourier transform (DFT) in one or more dimensions, of arbitrary input size, and of both real and complex data.
FFTW.MPI FFTW.MPI/3.3.10 FFTW is a C subroutine library for computing the discrete Fourier transform (DFT) in one or more dimensions, of arbitrary input size, and of both real and complex data.
FFMPEG FFmpeg/4.3.2
FFmpeg/4.4.2
FFmpeg/5.1.2
FFmpeg/6.0
A complete, cross-platform solution to record, convert and stream audio and video.
FLAC FLAC/1.3.3
FLAC/1.3.4
FLAC/1.4.2
FLAC/1.4.3
FLAC stands for Free Lossless Audio Codec, an audio format similar to MP3, but lossless, meaning that audio is compressed in FLAC without any loss in quality.
FLASH FLASH/2.2.00 FLASH (Fast Length Adjustment of SHort reads) is a very fast and accurate software tool to merge paired-end reads from next-generation sequencing experiments. FLASH is designed to merge pairs of reads when the original DNA fragments are shorter than twice the length of reads. The resulting longer reads can significantly improve genome assemblies. They can also improve transcriptome assembly when FLASH is used to merge RNA-seq data.
FLTK FLTK/1.3.8 FLTK is a cross-platform C++ GUI toolkit for UNIX/Linux (X11), Microsoft Windows, and MacOS X. FLTK provides modern GUI functionality without the bloat and supports 3D graphics via OpenGL and its built-in GLUT emulation.
FASTANI FastANI/1.33 FastANI is developed for fast alignment-free computation of whole-genome Average Nucleotide Identity (ANI). ANI is defined as mean nucleotide identity of orthologous gene pairs shared between two microbial genomes. FastANI supports pairwise comparison of both complete and draft genome assemblies.
FASTQC FastQC/0.11.9-Java-11 FastQC is a quality control application for high throughput sequence data. It reads in sequence data in a variety of formats and can either provide an interactive application to review the results of several different QC checks, or create an HTML based report which can be integrated into a pipeline.
FASTTREE FastTree/2.1.11 FastTree infers approximately-maximum-likelihood phylogenetic trees from alignments of nucleotide or protein sequences. FastTree can handle alignments with up to a million of sequences in a reasonable amount of time and memory.
FIJI Fiji/2.15.1 Fiji is an image processing package—a 'batteries-included' distribution of ImageJ, bundling a lot of plugins which facilitate scientific image analysis.
FIONA Fiona/1.8.21
Fiona/1.9.2
Fiona/1.9.5
Fiona is designed to be simple and dependable. It focuses on reading and writing data in standard Python IO style and relies upon familiar Python types and protocols such as files, dictionaries, mappings, and iterators instead of classes specific to OGR. Fiona can read and write real-world data using multi-layered GIS formats and zipped virtual file systems and integrates readily with other Python GIS packages such as pyproj, Rtree, and Shapely.
FIREFOX Firefox/138.0.3 Firefox is a free, open source Web browser for Windows, Linux and Mac OS X. It is based on the Mozilla code base and offers customization options and features such as its capability to block pop-up windows, tabbed browsing, privacy and security measures, smart searching, and RSS live bookmarks.
FLASK Flask/1.1.2
Flask/2.2.2
Flask is a lightweight WSGI web application framework. It is designed to make getting started quick and easy, with the ability to scale up to complex applications. This module includes the Flask extensions: Flask-Cors
FLEXIBLAS FlexiBLAS/3.0.4
FlexiBLAS/3.2.0
FlexiBLAS/3.2.1
FlexiBLAS/3.3.1
FlexiBLAS/3.4.4
FlexiBLAS is a wrapper library that enables the exchange of the BLAS and LAPACK implementation used by a program without recompiling or relinking it.
FREEXL FreeXL/1.0.6 FreeXL is an open source library to extract valid data from within an Excel (.xls) spreadsheet.
FRIBIDI FriBidi/1.0.10
FriBidi/1.0.12
FriBidi/1.0.13
The Free Implementation of the Unicode Bidirectional Algorithm.
GATB-CORE GATB-Core/1.4.2 GATB-Core is a high-performance and low memory footprint C++ library that provides a set of highly efficient algorithms to analyse NGS data sets
GATK GATK/4.3.0.0-Java-11
GATK/4.4.0.0-Java-17
The Genome Analysis Toolkit or GATK is a software package developed at the Broad Institute to analyse next-generation resequencing data. The toolkit offers a wide variety of tools, with a primary focus on variant discovery and genotyping as well as strong emphasis on data quality assurance. Its robust architecture, powerful processing engine and high-performance computing features make it capable of taking on projects of any size.
GCC GCC/8.3.0
GCC/10.2.0
GCC/10.3.0
GCC/11.2.0
GCC/11.3.0
GCC/12.2.0
GCC/12.3.0
GCC/13.1.0
GCC/13.2.0
GCC/13.3.0
GCC/14.2.0
The GNU Compiler Collection includes front ends for C, C++, Objective-C, Fortran, Java, and Ada, as well as libraries for these languages (libstdc++, libgcj,...).
GCCCORE GCCcore/8.2.0
GCCcore/8.3.0
GCCcore/10.2.0
GCCcore/10.3.0
GCCcore/11.2.0
GCCcore/11.3.0
GCCcore/12.2.0
GCCcore/12.3.0
GCCcore/13.1.0
GCCcore/13.2.0
GCCcore/13.3.0
GCCcore/14.2.0
The GNU Compiler Collection includes front ends for C, C++, Objective-C, Fortran, Java, and Ada, as well as libraries for these languages (libstdc++, libgcj,...).
GCONF GConf/3.2.6 GConf is a system for storing application preferences. It is intended for user preferences; not configuration of something like Apache, or arbitrary data storage.
GDAL GDAL/3.2.1
GDAL/3.3.0
GDAL/3.3.2
GDAL/3.5.0
GDAL/3.6.2
GDAL/3.7.1
GDAL/3.9.0
GDAL is a translator library for raster geospatial data formats that is released under an X/MIT style Open Source license by the Open Source Geospatial Foundation. As a library, it presents a single abstract data model to the calling application for all supported formats. It also comes with a variety of useful commandline utilities for data translation and processing.
GDB GDB/13.2 The GNU Project Debugger
GDRCOPY GDRCopy/2.1-CUDA-11.1.1
GDRCopy/2.2
GDRCopy/2.3
GDRCopy/2.3.1
GDRCopy/2.4
GDRCopy/2.4.1
A low-latency GPU memory copy library based on NVIDIA GPUDirect RDMA technology.
GEOS GEOS/3.9.1
GEOS/3.10.3
GEOS/3.11.1
GEOS/3.12.0
GEOS/3.12.1
GEOS (Geometry Engine - Open Source) is a C++ port of the Java Topology Suite (JTS)
GKLIB GKlib/5.1.1
GKlib/20231211
GKlib/20240119
GKlib/20240321
GKlib/20240329
A library of various helper routines and frameworks used by Karypis Lab software such as METIS.
GL2PS GL2PS/1.4.2 GL2PS: an OpenGL to PostScript printing library
GLFW GLFW/3.3.8 GLFW is an Open Source, multi-platform library for OpenGL, OpenGL ES and Vulkan development on the desktop
GLM GLM/0.9.9.8 OpenGL Mathematics (GLM) is a header only C++ mathematics library for graphics software based on the OpenGL Shading Language (GLSL) specifications.
GLPK GLPK/5.0 The GLPK (GNU Linear Programming Kit) package is intended for solving large-scale linear programming (LP), mixed integer programming (MIP), and other related problems. It is a set of routines written in ANSI C and organized in the form of a callable library.
GLIB GLib/2.66.1
GLib/2.68.2
GLib/2.69.1
GLib/2.72.1
GLib/2.75.0
GLib/2.77.1
GLib/2.78.1
GLib/2.81.0
GLib is one of the base libraries of the GTK+ project
GMAP-GSNAP GMAP-GSNAP/2021-12-17
GMAP-GSNAP/2023-02-17
GMAP-GSNAP/2023-04-20
GMAP: A Genomic Mapping and Alignment Program for mRNA and EST Sequences GSNAP: Genomic Short-read Nucleotide Alignment Program
GMP GMP/6.2.0
GMP/6.2.1
GMP/6.3.0
GMP is a free library for arbitrary precision arithmetic, operating on signed integers, rational numbers, and floating point numbers.
GOBJECT-INTROSPECTION GObject-Introspection/1.68.0
GObject-Introspection/1.72.0
GObject-Introspection/1.74.0
GObject-Introspection/1.76.1
GObject-Introspection/1.78.1
GObject-Introspection/1.80.1
GObject introspection is a middleware layer between C libraries (using GObject) and language bindings. The C library can be scanned at compile time and generate a metadata file, in addition to the actual native C library. Then at runtime, language bindings can read this metadata and automatically provide bindings to call into the C library.
GPAW GPAW/24.1.0 GPAW is a density-functional theory (DFT) Python code based on the projector-augmented wave (PAW) method and the atomic simulation environment (ASE). It uses real-space uniform grids and multigrid methods or atom-centered basis-functions.
GPAW-SETUPS GPAW-setups/0.9.20000 PAW setup for the GPAW Density Functional Theory package. Users can install setups manually using 'gpaw install-data' or use setups from this package. The versions of GPAW and GPAW-setups can be intermixed.
GPFLOW GPflow/2.9.0-CUDA-11.7.0-TensorFlow-2.11.0
gpflow/2.9.0-CUDA-11.7.0-TensorFlow-2.11.0
gpflow/2.9.0-CUDA-11.7.0
GPflow is a package for building Gaussian process models in python, using TensorFlow.
GPYTORCH GPyTorch/1.10-CUDA-11.7.0 GPyTorch is a Gaussian process library implemented using PyTorch.
GRASS GRASS/8.2.0
GRASS/8.3.1
The Geographic Resources Analysis Support System - used for geospatial data management and analysis, image processing, graphics and maps production, spatial modeling, and visualization
GROMACS GROMACS/2021.5-CUDA-11.4.1-PLUMED-2.8.0
GROMACS/2023.1-CUDA-11.7.0
GROMACS/2023.1-CUDA-12.2.0
GROMACS/2023.3-CUDA-11.8.0
GROMACS/2023.3-CUDA-12.1.1-PLUMED-2.9.0
GROMACS/2023.3
GROMACS/2024.1
GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. This is a GPU enabled build, containing both MPI and threadMPI builds for both single and double precision. It also contains the gmxapi extension for the single precision MPI build next to PLUMED.
GSL GSL/2.6
GSL/2.7
The GNU Scientific Library (GSL) is a numerical library for C and C++ programmers. The library provides a wide range of mathematical routines such as random number generators, special functions and least-squares fitting.
GST-PLUGINS-BAD GST-plugins-bad/1.20.2
GST-plugins-bad/1.22.5
GStreamer is a library for constructing graphs of media-handling components. The applications it supports range from simple Ogg/Vorbis playback, audio/video streaming to complex audio (mixing) and video (non-linear editing) processing.
GST-PLUGINS-BASE GST-plugins-base/1.18.5
GST-plugins-base/1.20.2
GST-plugins-base/1.22.1
GST-plugins-base/1.22.5
GStreamer is a library for constructing graphs of media-handling components. The applications it supports range from simple Ogg/Vorbis playback, audio/video streaming to complex audio (mixing) and video (non-linear editing) processing.
GSTREAMER GStreamer/1.18.5
GStreamer/1.20.2
GStreamer/1.22.1
GStreamer/1.22.5
GStreamer is a library for constructing graphs of media-handling components. The applications it supports range from simple Ogg/Vorbis playback, audio/video streaming to complex audio (mixing) and video (non-linear editing) processing.
GTK2 GTK2/2.24.33 The GTK+ 2 package contains libraries used for creating graphical user interfaces for applications.
GTK3 GTK3/3.24.31
GTK3/3.24.35
GTK3/3.24.37
GTK3/3.24.39
GTK+ is the primary library used to construct user interfaces in GNOME. It provides all the user interface controls, or widgets, used in a common graphical application. Its object-oriented API allows you to construct user interfaces without dealing with the low-level details of drawing and device interaction.
GTK4 GTK4/4.7.0
GTK4/4.13.1
GTK+ is the primary library used to construct user interfaces in GNOME. It provides all the user interface controls, or widgets, used in a common graphical application. Its object-oriented API allows you to construct user interfaces without dealing with the low-level details of drawing and device interaction.
GTS GTS/0.7.6 GTS stands for the GNU Triangulated Surface Library. It is an Open Source Free Software Library intended to provide a set of useful functions to deal with 3D surfaces meshed with interconnected triangles.
GDK-PIXBUF Gdk-Pixbuf/2.42.6
Gdk-Pixbuf/2.42.8
Gdk-Pixbuf/2.42.10
The Gdk Pixbuf is a toolkit for image loading and pixel buffer manipulation. It is used by GTK+ 2 and GTK+ 3 to load and manipulate images. In the past it was distributed as part of GTK+ 2 but it was split off into a separate package in preparation for the change to GTK+ 3.
GEANT4 Geant4/11.1.2 Geant4 is a toolkit for the simulation of the passage of particles through matter. Its areas of application include high energy, nuclear and accelerator physics, as well as studies in medical and space science.
GEANT4-DATA Geant4-data/11.1 Datasets for Geant4.
GENERATIVEMODELS GenerativeModels/0.2.1-CUDA-11.7.0
GHOSTSCRIPT Ghostscript/9.54.0
Ghostscript/9.56.1
Ghostscript/10.0.0
Ghostscript/10.01.2
Ghostscript/10.02.1
Ghostscript is a versatile processor for PostScript data with the ability to render PostScript to different targets. It used to be part of the cups printing stack, but is no longer used for that.
GITPYTHON GitPython/3.1.27
GitPython/3.1.40
GitPython is a python library used to interact with Git repositories
GLOBALARRAYS GlobalArrays/5.8.2 Global Arrays (GA) is a Partitioned Global Address Space (PGAS) programming model
GLOBUS-CLI Globus-CLI/3.6.0 A Command Line Wrapper over the Globus SDK for Python, which provides an interface to Globus services from the shell, and is suited to both interactive and simple scripting use cases.
GNUTLS GnuTLS/3.7.3
GnuTLS/3.7.8
GnuTLS is a secure communications library implementing the SSL, TLS and DTLS protocols and technologies around them. It provides a simple C language application programming interface (API) to access the secure communications protocols as well as APIs to parse and write X.509, PKCS #12, OpenPGP and other required structures. It is aimed to be portable and efficient with focus on security and interoperability.
GO Go/1.18.3
Go/1.22.1
Go is an open source programming language that makes it easy to build simple, reliable, and efficient software.
GRAPHBLAS GraphBLAS/8.2.1 SuiteSparse:GraphBLAS is a complete implementation of the GraphBLAS standard, which defines a set of sparse matrix operations on an extended algebra of semirings using an almost unlimited variety of operators and types. When applied to sparse adjacency matrices, these algebraic operations are equivalent to computations on graphs.
GRAPHENE Graphene/1.10.8 Graphene is a thin layer of types for graphic libraries
GRAPHICSMAGICK GraphicsMagick/1.3.36 GraphicsMagick is the swiss army knife of image processing.
GRAPHVIZ Graphviz/5.0.0 Graphviz is open source graph visualization software. Graph visualization is a way of representing structural information as diagrams of abstract graphs and networks. It has important applications in networking, bioinformatics, software engineering, database and web design, machine learning, and in visual interfaces for other technical domains.
GREENLET Greenlet/2.0.2
Greenlet/3.0.3
The greenlet package is a spin-off of Stackless, a version of CPython that supports micro-threads called "tasklets". Tasklets run pseudo-concurrently (typically in a single or a few OS-level threads) and are synchronized with data exchanges on "channels". A "greenlet", on the other hand, is a still more primitive notion of micro-thread with no implicit scheduling; coroutines, in other words. This is useful when you want to control exactly when your code runs.
GUILE Guile/3.0.7
Guile/3.0.9
Guile is a programming language, designed to help programmers create flexible applications that can be extended by users or other programmers with plug-ins, modules, or scripts.
GYMNASIUM Gymnasium/0.29.1 Gymnasium is an open source Python library for developing and comparing reinforcement learning algorithms by providing a standard API to communicate between learning algorithms and environments, as well as a standard set of environments compliant with that API.
HDF HDF/4.2.15
HDF/4.2.16-2
HDF (also known as HDF4) is a library and multi-object file format for storing and managing data between machines.
HDF-EOS HDF-EOS/2.20 HDF-EOS libraries are software libraries built on HDF libraries. It supports three data structures for remote sensing data: Grid, Point and Swath.
HDF-EOS5 HDF-EOS5/1.16 HDF-EOS libraries are software libraries built on HDF libraries. It supports three data structures for remote sensing data: Grid, Point and Swath.
HDF5 HDF5/1.10.7
HDF5/1.12.1
HDF5/1.12.2
HDF5/1.14.0
HDF5/1.14.2
HDF5/1.14.3
HDF5/1.14.5
HDF5 is a data model, library, and file format for storing and managing data. It supports an unlimited variety of datatypes, and is designed for flexible and efficient I/O and for high volume and complex data.
HH-SUITE HH-suite/3.3.0 The HH-suite is an open-source software package for sensitive protein sequence searching based on the pairwise alignment of hidden Markov models (HMMs).
HIPIFY HIPIFY/6.2.0 HIPIFY is a set of tools that you can use to automatically translate CUDA source code into portable HIP C++.
HISAT2 HISAT2/2.2.1 HISAT2 is a fast and sensitive alignment program for mapping next-generation sequencing reads (both DNA and RNA) against the general human population (as well as against a single reference genome).
HMMER HMMER/3.3.2
HMMER/3.4
HMMER is used for searching sequence databases for homologs of protein sequences, and for making protein sequence alignments. It implements methods using probabilistic models called profile hidden Markov models (profile HMMs). Compared to BLAST, FASTA, and other sequence alignment and database search tools based on older scoring methodology, HMMER aims to be significantly more accurate and more able to detect remote homologs because of the strength of its underlying mathematical models. In the past, this strength came at significant computational expense, but in the new HMMER3 project, HMMER is now essentially as fast as BLAST.
HPC-X HPC-X/2.14 NVIDIA HPC-X is a comprehensive software package that includes Message Passing Interface (MPI), Symmetrical Hierarchical Memory (SHMEM) and Partitioned Global Address Space (PGAS) communications libraries, and various acceleration packages.
HPL HPL/2.3 HPL is a software package that solves a (random) dense linear system in double precision (64 bits) arithmetic on distributed-memory computers. It can thus be regarded as a portable as well as freely available implementation of the High Performance Computing Linpack Benchmark.
HPRC_UTILS HPRC_utils/1.0 HPRC_utils is a collection of useful utilities to accompany software modules on the TAMU HPRC clusters.
HTSEQ HTSeq/2.0.2 HTSeq is a Python library to facilitate processing and analysis of data from high-throughput sequencing (HTS) experiments.
HTSLIB HTSlib/1.15.1
HTSlib/1.17
HTSlib/1.18
HTSlib/1.19.1
A C library for reading/writing high-throughput sequencing data. This package includes the utilities bgzip and tabix
HUMANN HUMAnN/3.9
humann/3.6
HUMAnN is a pipeline for efficiently and accurately determining the coverage and abundance of microbial pathways in a community from metagenomic data.
HARFBUZZ HarfBuzz/2.8.1
HarfBuzz/2.8.2
HarfBuzz/4.2.1
HarfBuzz/5.3.1
HarfBuzz/8.2.2
HarfBuzz is an OpenType text shaping engine.
HEFFTE HeFFTe/2.4.0 Highly Efficient FFT for Exascale (HeFFTe) library
HIGHWAY Highway/1.0.3
Highway/1.0.4
Highway/1.0.7
Highway is a C++ library for SIMD (Single Instruction, Multiple Data), i.e. applying the same operation to 'lanes'.
HOROVOD Horovod/0.22.1-CUDA-11.3.1-TensorFlow-2.6.0
Horovod/0.28.1-CUDA-11.7.0-TensorFlow-2.11.0
Horovod/0.28.1-CUDA-11.7.0-PyTorch-1.12.1
Horovod is a distributed training framework for TensorFlow.
HYPEROPT Hyperopt/0.2.7 hyperopt is a Python library for optimizing over awkward search spaces with real-valued, discrete, and conditional dimensions.
HYPRE Hypre/2.21.0
Hypre/2.25.0
Hypre/2.27.0
Hypre/2.29.0
Hypre/2.31.0
Hypre is a library for solving large, sparse linear systems of equations on massively parallel computers. The problems of interest arise in the simulation codes being developed at LLNL and elsewhere to study physical phenomena in the defense, environmental, energy, and biological sciences.
ICON ICON/2024.01
ICON/2024.07
ICON is a flexible, scalable, high-performance modelling framework for weather, climate and environmental prediction that provides actionable information for society and advances our understanding of the Earth's climate system.
ICU ICU/67.1
ICU/69.1
ICU/71.1
ICU/72.1
ICU/73.2
ICU/74.1
ICU/75.1
ICU is a mature, widely used set of C/C++ and Java libraries providing Unicode and Globalization support for software applications.
IJULIA IJulia/1.24.2-Julia-1.10.3 Julia kernel for Jupyter
IML IML/1.0.5 IML is a free library of C source code which implements algorithms for computing exact solutions to dense systems of linear equations over the integers.
IPYTHON IPython/7.26.0
IPython/8.5.0
IPython/8.14.0
IPython/8.17.2
IPython provides a rich architecture for interactive computing with: Powerful interactive shells (terminal and Qt-based). A browser-based notebook with support for code, text, mathematical expressions, inline plots and other rich media. Support for interactive data visualization and use of GUI toolkits. Flexible, embeddable interpreters to load into your own projects. Easy to use, high performance tools for parallel computing.
IRKERNEL IRkernel/1.3.2-R-4.3.2 The R kernel for the 'Jupyter' environment executes R code which the front-end (Jupyter Notebook or other front-ends) submits to the kernel via the network.
ISA-L ISA-L/2.30.0 Intelligent Storage Acceleration Library
ISL ISL/0.26 isl is a library for manipulating sets and relations of integer points bounded by linear constraints.
ITK ITK/5.2.1 Insight Segmentation and Registration Toolkit (ITK) provides an extensive suite of software tools for registering and segmenting multidimensional imaging data.
IGPROF IgProf/5.9.18 IgProf is a simple nice tool for measuring and analysing application memory and performance characteristics.
IMAGEJ ImageJ/1.53t-Java-11 Image Processing and Analysis in Java
IMAGEMAGICK ImageMagick/7.0.11-14
ImageMagick/7.1.0-4
ImageMagick/7.1.0-37
ImageMagick/7.1.0-53
ImageMagick/7.1.1-15
ImageMagick/7.1.1-34
ImageMagick is a software suite to create, edit, compose, or convert bitmap images
IMATH Imath/3.1.5
Imath/3.1.6
Imath/3.1.7
Imath/3.1.9
Imath is a C++ and python library of 2D and 3D vector, matrix, and math operations for computer graphics
INFERNAL Infernal/1.1.4 Infernal ("INFERence of RNA ALignment") is for searching DNA sequence databases for RNA structure and sequence similarities.
INTELCLUSTERCHECKER IntelClusterChecker/2021.5.0 Intel Cluster Checker verifies the configuration and performance of Linux OS-based clusters. Anomalies and performance differences can be identified and practical resolutions provided.
JANSSON Jansson/2.13.1 Jansson is a C library for encoding, decoding and manipulating JSON data. Its main features and design principles are: * Simple and intuitive API and data model * Comprehensive documentation * No dependencies on other libraries * Full Unicode support (UTF-8) * Extensive test suite
JASPER JasPer/1.900.1
JasPer/2.0.24
JasPer/2.0.28
JasPer/2.0.33
JasPer/4.0.0
The JasPer Project is an open-source initiative to provide a free software-based reference implementation of the codec specified in the JPEG-2000 Part-1 standard.
JAVA Java/1.8.0_371
Java/11.0.16
Java/11.0.18
Java/17.0.6
Java/21.0.2
Java Platform, Standard Edition (Java SE) lets you develop and deploy Java applications on desktops and servers.
JELLYFISH Jellyfish/2.3.0 Jellyfish is a tool for fast, memory-efficient counting of k-mers in DNA.
JMOL Jmol/16.1.59-Java-1.8.0_371
Jmol/16.1.59
Jmol: an open-source Java viewer for chemical structures in 3D with features for chemicals, crystals, materials and biomolecules
JSONCPP JsonCpp/1.9.4
JsonCpp/1.9.5
JsonCpp is a C++ library that allows manipulating JSON values, including serialization and deserialization to and from strings. It can also preserve existing comment in unserialization/serialization steps, making it a convenient format to store user input files.
JUDY Judy/1.0.5 A C library that implements a dynamic array.
JULIA Julia/1.8.5-linux-x86_64
Julia/1.9.3-linux-x86_64
Julia/1.10.0-musl-x86_64
Julia/1.10.2-linux-x86_64
Julia/1.10.3-linux-x86_64
Julia/1.11.4-linux-x86_64
Julia is a high-level, high-performance dynamic programming language for numerical computing
JULIA_TAMU Julia_TAMU/1.10.2 Julia is a high-level, high-performance dynamic programming language for numerical computing.. - Homepage: https://julialang.org
JUPYTER-BUNDLE Jupyter-bundle/20230823 This bundle collects a range of Jupyter interfaces (Lab, Notebook and nbclassic), extensions (Jupyter Server Proxy, Jupyter Resource Monitor, Jupyter Lmod) and the JupyterHub.
JUPYTERHUB JupyterHub/4.0.2 JupyterHub is a multiuser version of the Jupyter (IPython) notebook designed for centralized deployments in companies, university classrooms and research labs.
JUPYTERLAB JupyterLab/3.5.0
JupyterLab/4.0.3
JupyterLab/4.0.5
JupyterLab/4.2.0
JupyterLab is the next-generation user interface for Project Jupyter offering all the familiar building blocks of the classic Jupyter Notebook (notebook, terminal, text editor, file browser, rich outputs, etc.) in a flexible and powerful user interface. JupyterLab will eventually replace the classic Jupyter Notebook.
JUPYTERNOTEBOOK JupyterNotebook/7.0.2
JupyterNotebook/7.0.3
The Jupyter Notebook is the original web application for creating and sharing computational documents. It offers a simple, streamlined, document-centric experience.
KMCP KMCP/0.9.1 KMCP: accurate metagenomic profiling of both prokaryotic and viral populations by pseudo-mapping
KAHIP KaHIP/3.14
KaHIP/3.16
The graph partitioning framework KaHIP -- Karlsruhe High Quality Partitioning.
KALEIDO Kaleido/0.2.1 Fast static image export for web-based visualization libraries with zero dependencies
KALIGN Kalign/3.3.1
Kalign/3.3.5
Kalign/3.4.0
Kalign is a fast multiple sequence alignment program for biological sequences.
KERAS Keras/2.4.3-TensorFlow-2.5.0 Keras is a deep learning API written in Python, running on top of the machine learning platform TensorFlow.
KRAKEN2 Kraken2/2.1.2 Kraken is a system for assigning taxonomic labels to short DNA sequences, usually obtained through metagenomic studies. Previous attempts by other bioinformatics software to accomplish this task have often used sequence alignment or machine learning techniques that were quite slow, leading to the development of less sensitive but much faster abundance estimation programs. Kraken aims to achieve high sensitivity and high speed by utilizing exact alignments of k-mers and a novel classification algorithm.
LAME LAME/3.100 LAME is a high quality MPEG Audio Layer III (MP3) encoder licensed under the LGPL.
LAMMPS LAMMPS/patch_19Nov2024-intel-kokkos
LAMMPS/2Aug2023_update2-CUDA-11.8.0-sm90
LAMMPS/2Aug2023_update2-intel-2023.07
LAMMPS/2Aug2023_update2-kokkos-CUDA-12.1.1
LAMMPS/3Aug2023-intel-2023.07
LAMMPS/23Jun2022_update4-kokkos-CUDA-11.4.1
LAMMPS/23Jun2022-kokkos-CUDA-11.4.1
LAMMPS/23Jun2022-kokkos-extra-pair-styles
LAMMPS/23Jun2022-kokkos
LAMMPS is a classical molecular dynamics code with a focus on materials modeling.
LASSO-PYTHON LASSO-Python/2.0.0 This python library is designed for general purpose usage in the field of Computer Aided Engineering (CAE). It's name originates from the original initiator and donator of the project Lasso GmbH. The library is now maintained by an open-source community.
LERC LERC/4.0.0 LERC is an open-source image or raster format which supports rapid encoding and decoding for any pixel type (not just RGB or Byte). Users set the maximum compression error per pixel while encoding, so the precision of the original input image is preserved (within user defined error bounds).
LLVM LLVM/10.0.1
LLVM/11.1.0
LLVM/12.0.1
LLVM/13.0.1
LLVM/14.0.3
LLVM/14.0.6-llvmlite
LLVM/14.0.6
LLVM/15.0.5
LLVM/16.0.6
LLVM/18.1.8
The LLVM Core libraries provide a modern source- and target-independent optimizer, along with code generation support for many popular CPUs (as well as some less common ones!) These libraries are built around a well specified code representation known as the LLVM intermediate representation ("LLVM IR"). The LLVM Core libraries are well documented, and it is particularly easy to invent your own language (or port an existing compiler) to use LLVM as an optimizer and code generator.
LMDB LMDB/0.9.24
LMDB/0.9.28
LMDB/0.9.29
LMDB/0.9.31
LMDB is a fast, memory-efficient database. With memory-mapped files, it has the read performance of a pure in-memory database while retaining the persistence of standard disk-based databases.
LZO LZO/2.10 Portable lossless data compression library
LEPTONICA Leptonica/1.83.0
Leptonica/1.84.1
Leptonica is a collection of pedagogically-oriented open source software that is broadly useful for image processing and image analysis applications.
LEVELDB LevelDB/1.22 LevelDB is a fast key-value storage library written at Google that provides an ordered mapping from string keys to string values.
LIBSOUP LibSoup/3.0.7 libsoup is an HTTP client/server library for GNOME. It uses GObjects and the glib main loop, to integrate well with GNOME applications, and also has a synchronous API, for use in threaded applications.
LIBSTDCOMPAT LibStdCompat/20250218-76b61ae LibStdCompat is a set of compatibility headers for C++ 14, 17, and 20 for C++11.
LIBTIFF LibTIFF/4.1.0
LibTIFF/4.2.0
LibTIFF/4.3.0
LibTIFF/4.4.0
LibTIFF/4.5.0
LibTIFF/4.6.0
tiff: Library and tools for reading and writing TIFF data files
LIBINT Libint/2.7.2-lmax-6-cp2k Libint library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory.
LITTLECMS LittleCMS/2.12
LittleCMS/2.13.1
LittleCMS/2.14
LittleCMS/2.15
Little CMS intends to be an OPEN SOURCE small-footprint color management engine, with special focus on accuracy and performance.
LUA Lua/5.4.4
Lua/5.4.6
Lua is a powerful, fast, lightweight, embeddable scripting language. Lua combines simple procedural syntax with powerful data description constructs based on associative arrays and extensible semantics. Lua is dynamically typed, runs by interpreting bytecode for a register-based virtual machine, and has automatic memory management with incremental garbage collection, making it ideal for configuration, scripting, and rapid prototyping.
M4 M4/1.4.18
M4/1.4.19
GNU M4 is an implementation of the traditional Unix macro processor. It is mostly SVR4 compatible although it has some extensions (for example, handling more than 9 positional parameters to macros). GNU M4 also has built-in functions for including files, running shell commands, doing arithmetic, etc.
MAFFT MAFFT/7.505-with-extensions
MAFFT/7.520-with-extensions
MAFFT is a multiple sequence alignment program for unix-like operating systems. It offers a range of multiple alignment methods, L-INS-i (accurate; for alignment of <∼200 sequences), FFT-NS-2 (fast; for alignment of <∼30,000 sequences), etc.
MATIO MATIO/1.5.23 matio is an C library for reading and writing Matlab MAT files.
MDI MDI/1.4.26 The MolSSI Driver Interface (MDI) project provides a standardized API for fast, on-the-fly communication between computational chemistry codes. This greatly simplifies the process of implementing methods that require the cooperation of multiple software packages and enables developers to write a single implementation that works across many different codes. The API is sufficiently general to support a wide variety of techniques, including QM/MM, ab initio MD, machine learning, advanced sampling, and path integral MD, while also being straightforwardly extensible. Communication between codes is handled by the MDI Library, which enables tight coupling between codes using either the MPI or TCP/IP methods.
MDTRAJ MDTraj/1.9.9 Read, write and analyze MD trajectories with only a few lines of Python code.
METIS METIS/5.1.0 METIS is a set of serial programs for partitioning graphs, partitioning finite element meshes, and producing fill reducing orderings for sparse matrices. The algorithms implemented in METIS are based on the multilevel recursive-bisection, multilevel k-way, and multi-constraint partitioning schemes.
MFEM MFEM/4.7-CUDA-12.6.0
MFEM/70941b4
MFEM is a modular parallel C++ library for finite element methods. MFEM can be viewed as a finite element toolbox that provides the building blocks for developing finite element algorithms in a manner similar to that of MATLAB for linear algebra methods.
MGARD MGARD/1.5.2 MGARD (MultiGrid Adaptive Reduction of Data) is a technique for multilevel lossy compression and refactoring of scientific data based on the theory of multigrid methods.
MMSEQS2 MMseqs2/14-7e284 MMseqs2: ultra fast and sensitive search and clustering suite
MOAB MOAB/20250227-9f72cdd The Mesh-Oriented datABase (MOAB) is a component for representing and evaluating mesh data. MOAB can store and represent structured and unstructured meshes consisting of elements in the finite element zoo, including polygons and polyhedra.
MONAI MONAI/1.0.1 MONAI is a PyTorch-based, open-source framework for deep learning in healthcare imaging, part of PyTorch Ecosystem.
MPC MPC/1.2.1
MPC/1.3.1
Gnu Mpc is a C library for the arithmetic of complex numbers with arbitrarily high precision and correct rounding of the result. It extends the principles of the IEEE-754 standard for fixed precision real floating point numbers to complex numbers, providing well-defined semantics for every operation. At the same time, speed of operation at high precision is a major design goal.
MPFR MPFR/4.1.0
MPFR/4.2.0
MPFR/4.2.1
The MPFR library is a C library for multiple-precision floating-point computations with correct rounding.
MPICH MPICH/4.2.1 MPICH is a high-performance and widely portable implementation of the Message Passing Interface (MPI) standard (MPI-1, MPI-2 and MPI-3).
MUMPS MUMPS/5.4.0-metis
MUMPS/5.5.1-metis
MUMPS/5.6.1-metis
A parallel sparse direct solver
MUMMER MUMmer/4.0.0rc1 MUMmer is a system for rapidly aligning entire genomes, whether in complete or draft form. AMOS makes use of it.
MVAPICH-PLUS MVAPICH-Plus/4.0pre-GCC-11.1.0-CUDA-12.2-OFED-5.0
MVAPICH-Plus/4.0-GCC-13.2.0-CUDA-12.4-UCX-SLURM
The new MVAPICH-Plus series is an advanced version of the MVAPICH MPI library. It is targeted to support unified MVAPICH2-GDR and MVAPICH2-X features. It is also targeted to provide optimized support for modern platforms (CPU, GPU, and interconnects) for HPC, Deep Learning, Machine Learning, Big Data and Data Science applications. MVAPICH-Plus 4.0a with support for unified MVAPICH2-GDR and MVAPICH2-X features is available. Features of this release include: support for various HPC fabrics (InfiniBand, Slingshot, Omni-Path, OPX, RoCE, and Ethernet/iWARP), various CPUs (x86, ARM, and OpenPOWER), and various GPUs (NVIDIA, AMD, and Intel), CMA support for intra-node pt2pt communication, CUDA-aware MPI (pt2pt and collective) support, IPC-based support for collectives on Intel GPU, on-the-fly compression support for collectives for NVIDIA GPUs.
MVAPICH2-GDR MVAPICH2-GDR/2.3.7-GCC-11.2.0-CUDA-11.4.1 MVAPICH2-GDR 2.3.7 binary release is based on MVAPICH2 2.3.7 and incorporates designs that take advantage of GPUDirect RDMA technology enabling direct P2P communication between NVIDIA GPUs and Mellanox InfiniBand adapters.
MAGICS Magics/4.13.0 Magics is ECMWF's meteorological plotting software and can be either accessed directly through its Python or Fortran interfaces or by using Metview.
MAKO Mako/1.1.3
Mako/1.1.4
Mako/1.2.0
Mako/1.2.4
Mako/1.3.5
A super-fast templating language that borrows the best ideas from the existing templating languages
MAMBA Mamba/23.1.0-4 Mamba is a fast, robust, and cross-platform package manager. It runs on Windows, OS X and Linux (ARM64 and PPC64LE included) and is fully compatible with conda packages and supports most of conda's commands.
MARIADB MariaDB/10.9.3 MariaDB is an enhanced, drop-in replacement for MySQL. Included engines: myISAM, Aria, InnoDB, RocksDB, TokuDB, OQGraph, Mroonga.
MASH Mash/2.3 Fast genome and metagenome distance estimation using MinHash
MATLAB Matlab/R2023a
Matlab/R2023b
Matlab/R2024a
Matlab/R2024b
A numerical computing environment and fourth-generation programming language. - Homepage: http://www.mathworks.com/products/matlab/
MAVEN Maven/3.9.6 Binary maven install, Apache Maven is a software project management and comprehension tool. Based on the concept of a project object model (POM), Maven can manage a project's build, reporting and documentation from a central piece of information.
MEMORYVIEWER MemoryViewer/1.0 MemoryViewer software gives system administrators comprehensive insight into the physical memory topology as well as the application memory utilization.
MERCURIAL Mercurial/6.4.5 Mercurial is a free, distributed source control management tool. It efficiently handles projects of any size and offers an easy and intuitive interface.
MERCURY Mercury/2.4.0
mercury/2.4.0
Mercury is a Remote Procedure Call (RPC) framework specifically designed for use in High-Performance Computing (HPC) systems with high-performance fabrics.
MESA Mesa/21.1.1
Mesa/21.1.7
Mesa/22.0.3
Mesa/22.2.4-LLVM-14.0.6
Mesa/22.2.4
Mesa/23.1.4
Mesa/23.1.9
Mesa/24.1.3
Mesa is an open-source implementation of the OpenGL specification - a system for rendering interactive 3D graphics.
MESON Meson/0.55.3
Meson/0.58.0
Meson/0.58.2
Meson/0.62.1
Meson/0.64.0
Meson/1.1.1
Meson/1.2.3
Meson/1.4.0
Meson is a cross-platform build system designed to be both as fast and as user friendly as possible.
METAEUK MetaEuk/6 MetaEuk is a modular toolkit designed for large-scale gene discovery and annotation in eukaryotic metagenomic contigs.
METAPHLAN MetaPhlAn/3.0.14 MetaPhlAn is a computational tool for profiling the composition of microbial communities (Bacteria, Archaea, Eukaryotes and Viruses) from metagenomic shotgun sequencing data (i.e. not 16S) with species-level. With the newly added StrainPhlAn module, it is now possible to perform accurate strain-level microbial profiling.
MINPATH MinPath/1.6 MinPath (Minimal set of Pathways) is a parsimony approach for biological pathway reconstructions using protein family predictions, achieving a more conservative, yet more faithful, estimation of the biological pathways for a query dataset.
MINICONDA3 Miniconda3/4.12.0
Miniconda3/22.11.1-1
Miniconda3/23.3.1-0
Miniconda3/23.5.2-0
Miniconda3/23.9.0-0
Miniconda3/23.10.0-1
Miniconda is a free minimal installer for conda. It is a small, bootstrap version of Anaconda that includes only conda, Python, the packages they depend on, and a small number of other useful packages.
MINIFORGE3 Miniforge3/24.11.3-0
Miniforge3/25.3.0-3
Miniforge is a free minimal installer for conda and Mamba specific to conda-forge.
MUJOCO MuJoCo/3.1.4 MuJoCo stands for Multi-Joint dynamics with Contact. It is a general purpose physics engine that aims to facilitate research and development in robotics, biomechanics, graphics and animation, machine learning, and other areas which demand fast and accurate simulation of articulated structures interacting with their environment.
MULTIQC MultiQC/1.14 Aggregate results from bioinformatics analyses across many samples into a single report. MultiQC searches a given directory for analysis logs and compiles an HTML report. It's a general use tool, perfect for summarising the output from numerous bioinformatics tools.
NAMD NAMD/2.14-mpi NAMD is a parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems.
NAMD-MULTICORE-CUDA NAMD-multicore-CUDA/3.0b3 A parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems.
NAMD-NETLRTS-SMP-CUDA NAMD-netlrts-smp-CUDA/3.0b3 A parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems.
NAMD-VERBS-SMP-CUDA NAMD-verbs-smp-CUDA/3.0b3 A parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems.
NASM NASM/2.15.05
NASM/2.16.01
NASM/2.16.03
NASM: General-purpose x86 assembler
NCCL NCCL/2.8.3-CUDA-11.1.1
NCCL/2.10.3-CUDA-11.3.1
NCCL/2.10.3-CUDA-11.4.1
NCCL/2.12.12-CUDA-11.7.0
NCCL/2.12.12-CUDA-11.8.0
NCCL/2.16.2-CUDA-12.0.0
NCCL/2.18.3-CUDA-12.1.1
NCCL/2.20.5-CUDA-12.2.0
NCCL/2.20.5-CUDA-12.4.0
NCCL/2.20.5-CUDA-12.4.1
NCCL/2.20.5-CUDA-12.5.0
NCCL/2.22.3-CUDA-12.6.0
The NVIDIA Collective Communications Library (NCCL) implements multi-GPU and multi-node collective communication primitives that are performance optimized for NVIDIA GPUs.
NCL NCL/6.6.2 NCL is an interpreted language designed specifically for scientific data analysis and visualization.
NCO NCO/5.0.1 The NCO toolkit manipulates and analyzes data stored in netCDF-accessible formats, including DAP, HDF4, and HDF5.
NEDIT NEdit/5.7.7 A fast, compact Motif/X11 plain text editor, for most popular Unix systems.
NLTK NLTK/3.8.1 NLTK is a leading platform for building Python programs to work with human language data.
NLOPT NLopt/2.7.0
NLopt/2.7.1
NLopt is a free/open-source library for nonlinear optimization, providing a common interface for a number of different free optimization routines available online as well as original implementations of various other algorithms.
NSPR NSPR/4.32
NSPR/4.34
NSPR/4.35
Netscape Portable Runtime (NSPR) provides a platform-neutral API for system level and libc-like functions.
NSS NSS/3.69
NSS/3.79
NSS/3.85
NSS/3.89.1
NSS/3.94
Network Security Services (NSS) is a set of libraries designed to support cross-platform development of security-enabled client and server applications.
NTL NTL/11.5.1 NTL is a high-performance, portable C++ library providing data structures and algorithms for manipulating signed, arbitrary length integers, and for vectors, matrices, and polynomials over the integers and over finite fields.
NTPOLY NTPoly/2.7.0 is a massively parallel library for computing the functions of sparse, symmetric matrices based on polynomial expansions. For sufficiently sparse matrices, most of the matrix functions in NTPoly can be computed in linear time.
NVHPC NVHPC/21.9
NVHPC/22.9-CUDA-11.7.0
NVHPC/22.11-CUDA-11.7.0
NVHPC/22.11-CUDA-11.8.0
NVHPC/23.1-CUDA-12.0.0
NVHPC/23.7-CUDA-12.1.1
NVHPC/23.7-CUDA-12.2.0
NVHPC/24.1-CUDA-12.3.0
NVHPC/24.9-CUDA-12.6.0
NVHPC/25.1-CUDA-12.6.0
C, C++ and Fortran compilers included with the NVIDIA HPC SDK (previously: PGI)
NVSHMEM NVSHMEM/2.8.0-CUDA-11.7.0
NVSHMEM/2.8.0-CUDA-12.1.1
NVSHMEM/2.8.0-CUDA-12.5.0
NVSHMEM/2.11.0-CUDA-12.5.0
NVSHMEM/3.0.6-CUDA-12.5.0
NVSHMEM is a parallel programming interface based on OpenSHMEM that provides efficient and scalable communication for NVIDIA GPU clusters. NVSHMEM creates a global address space for data that spans the memory of multiple GPUs and can be accessed with fine-grained GPU-initiated operations, CPU-initiated operations, and operations on CUDA streams.
NEXTFLOW Nextflow/23.10.0 Nextflow is a reactive workflow framework and a programming DSL that eases writing computational pipelines with complex data
NIBABEL NiBabel/4.0.2 NiBabel provides read/write access to some common medical and neuroimaging file formats, including: ANALYZE (plain, SPM99, SPM2 and later), GIFTI, NIfTI1, NIfTI2, MINC1, MINC2, MGH and ECAT as well as Philips PAR/REC. We can read and write Freesurfer geometry, and read Freesurfer morphometry and annotation files. There is some very limited support for DICOM. NiBabel is the successor of PyNIfTI.
NINJA Ninja/1.10.1
Ninja/1.10.2
Ninja/1.11.1
Ninja/1.12.1
Ninja is a small build system with a focus on speed.
OCAML OCaml/5.1.1 OCaml is a general purpose industrial-strength programming language with an emphasis on expressiveness and safety. Developed for more than 20 years at Inria it benefits from one of the most advanced type systems and supports functional, imperative and object-oriented styles of programming.
ONNX ONNX/1.15.0 Open Neural Network Exchange (ONNX) is an open ecosystem that empowers AI developers to choose the right tools as their project evolves. ONNX provides an open source format for AI models, both deep learning and traditional ML. It defines an extensible computation graph model, as well as definitions of built-in operators and standard data types. Currently we focus on the capabilities needed for inferencing (scoring).
ONNX-RUNTIME ONNX-Runtime/1.16.3 ONNX Runtime inference can enable faster customer experiences and lower costs, supporting models from deep learning frameworks such as PyTorch and TensorFlow/Keras as well as classical machine learning libraries such as scikit-learn, LightGBM, XGBoost, etc. ONNX Runtime is compatible with different hardware, drivers, and operating systems, and provides optimal performance by leveraging hardware accelerators where applicable alongside graph optimizations and transforms.
OPARI2 OPARI2/2.0.7
OPARI2/2.0.8
OPARI2, the successor of Forschungszentrum Juelich's OPARI, is a source-to-source instrumentation tool for OpenMP and hybrid codes. It surrounds OpenMP directives and runtime library calls with calls to the POMP2 measurement interface.
ORCA ORCA/6.0.1-avx2 ORCA is a flexible, efficient and easy-to-use general purpose tool for quantum chemistry with specific emphasis on spectroscopic properties of open-shell molecules. It features a wide variety of standard quantum chemical methods ranging from semiempirical methods to DFT to single- and multireference correlated ab initio methods. It can also treat environmental and relativistic effects.
OSU-MICRO-BENCHMARKS OSU-Micro-Benchmarks/7.1-1 OSU Micro-Benchmarks
OTF2 OTF2/3.0.3
otf2/3.0.3
The Open Trace Format 2 is a highly scalable, memory efficient event trace data format plus support library. It is the new standard trace format for Scalasca, Vampir, and TAU and is open for other tools.
OPENBLAS OpenBLAS/0.3.12
OpenBLAS/0.3.15
OpenBLAS/0.3.18
OpenBLAS/0.3.20
OpenBLAS/0.3.21
OpenBLAS/0.3.23
OpenBLAS/0.3.24
OpenBLAS/0.3.27
OpenBLAS is an optimized BLAS library based on GotoBLAS2 1.13 BSD version.
OPENBABEL OpenBabel/3.1.1 Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It's an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas.
OPENCV OpenCV/4.6.0-contrib
OpenCV/4.6.0-CUDA-11.7.0-contrib
OpenCV/4.8.1-contrib
OpenCV (Open Source Computer Vision Library) is an open source computer vision and machine learning software library. OpenCV was built to provide a common infrastructure for computer vision applications and to accelerate the use of machine perception in the commercial products. Includes extra modules for OpenCV from the contrib repository.
OPENEXR OpenEXR/3.1.5
OpenEXR/3.1.7
OpenEXR/3.2.0
OpenEXR is a high dynamic-range (HDR) image file format developed by Industrial Light & Magic for use in computer imaging applications
OPENFOAM OpenFOAM/v2206
OpenFOAM/v2306
OpenFOAM/v2312
OpenFOAM/v2406
OpenFOAM/10
OpenFOAM/11
OpenFOAM/12
OpenFOAM is a free, open source CFD software package. OpenFOAM has an extensive range of features to solve anything from complex fluid flows involving chemical reactions, turbulence and heat transfer, to solid dynamics and electromagnetics.
OPENFOLD OpenFold/1.0.1-CUDA-11.3.1
OpenFold/2.1.0-CUDA-12.1.1
A faithful PyTorch reproduction of DeepMind's AlphaFold 2
OPENIMAGEIO OpenImageIO/2.3.17.0 OpenImageIO is a library for reading and writing images, and a bunch of related classes, utilities, and applications.
OPENJPEG OpenJPEG/2.4.0
OpenJPEG/2.5.0
OpenJPEG is an open-source JPEG 2000 codec written in C language. It has been developed in order to promote the use of JPEG 2000, a still-image compression standard from the Joint Photographic Experts Group (JPEG). Since may 2015, it is officially recognized by ISO/IEC and ITU-T as a JPEG 2000 Reference Software.
OPENMM OpenMM/7.5.1-CUDA-11.3.1-DeepMind-patch
OpenMM/7.5.1-DeepMind-patch
OpenMM/7.7.0
OpenMM/8.0.0-CUDA-11.7.0
OpenMM/8.0.0-CUDA-11.8.0
OpenMM/8.0.0-CUDA-12.1.1
OpenMM/8.0.0
OpenMM/8.2.0
OpenMM is a toolkit for molecular simulation.
OPENMPI OpenMPI/nostub-4.1.4
OpenMPI/4.0.5
OpenMPI/4.1.1
OpenMPI/4.1.4-CUDA-11.8.0
OpenMPI/4.1.4-PyFR
OpenMPI/4.1.4
OpenMPI/4.1.5
OpenMPI/4.1.6-CUDA-12.5.0-PyFR
OpenMPI/4.1.6-CUDA-12.5.0
OpenMPI/4.1.6
OpenMPI/5.0.3-CUDA-12.5.0-PyFR
OpenMPI/5.0.3-CUDA-12.5.0
OpenMPI/5.0.3
The Open MPI Project is an open source MPI-3 implementation.
OPENPGM OpenPGM/5.2.122 OpenPGM is an open source implementation of the Pragmatic General Multicast (PGM) specification in RFC 3208 available at www.ietf.org. PGM is a reliable and scalable multicast protocol that enables receivers to detect loss, request retransmission of lost data, or notify an application of unrecoverable loss. PGM is a receiver-reliable protocol, which means the receiver is responsible for ensuring all data is received, absolving the sender of reception responsibility.
OPENSSL OpenSSL/1.1
OpenSSL/1.1.1q
OpenSSL/3
OpenSSL/3.1.5
The OpenSSL Project is a collaborative effort to develop a robust, commercial-grade, full-featured, and Open Source toolchain implementing the Secure Sockets Layer (SSL v2/v3) and Transport Layer Security (TLS v1) protocols as well as a full-strength general purpose cryptography library.
OPENSCENEGRAPH OpenSceneGraph/3.6.5 The OpenSceneGraph is an open source high performance 3D graphics toolkit, used by application developers in fields such as visual simulation, games, virtual reality, scientific visualization and modelling. Written entirely in Standard C++ and OpenGL it runs on all Windows platforms, OSX, GNU/Linux, IRIX, Solaris, HP-Ux, AIX and FreeBSD operating systems. The OpenSceneGraph is now well established as the world leading scene graph technology, used widely in the vis-sim, space, scientific, oil-gas, games and virtual reality industries.
OPENSUBDIV OpenSubdiv/3.6.0 OpenSubdiv is a set of open source libraries that implement high performance subdivision surface (subdiv) evaluation on massively parallel CPU and GPU architectures.
OPTIX OptiX/7.2.0 OptiX is NVIDIA SDK for easy ray tracing performance. It provides a simple framework for accessing the GPU’s massive ray tracing power using state-of-the-art GPU algorithms.
OPTUNA Optuna/3.1.0 Optuna is an automatic hyperparameter optimization software framework, particularly designed for machine learning. It features an imperative, define-by-run style user API. Thanks to our define-by-run API, the code written with Optuna enjoys high modularity, and the user of Optuna can dynamically construct the search spaces for the hyperparameters.
PAPI PAPI/7.0.0
PAPI/7.0.1
PAPI/7.1.0
PAPI provides the tool designer and application engineer with a consistent interface and methodology for use of the performance counter hardware found in most major microprocessors. PAPI enables software engineers to see, in near real time, the relation between software performance and processor events. In addition Component PAPI provides access to a collection of components that expose performance measurement opportunites across the hardware and software stack.
PASA PASA/2.5.3 PASA, acronym for Program to Assemble Spliced Alignments (and pronounced 'pass-uh'), is a eukaryotic genome annotation tool that exploits spliced alignments of expressed transcript sequences to automatically model gene structures, and to maintain gene structure annotation consistent with the most recently available experimental sequence data. PASA also identifies and classifies all splicing variations supported by the transcript alignments.
PCRE PCRE/8.44
PCRE/8.45
The PCRE library is a set of functions that implement regular expression pattern matching using the same syntax and semantics as Perl 5.
PCRE2 PCRE2/10.36
PCRE2/10.37
PCRE2/10.40
PCRE2/10.42
PCRE2/10.43
The PCRE library is a set of functions that implement regular expression pattern matching using the same syntax and semantics as Perl 5.
PDAL PDAL/2.4.3
PDAL/2.6.0
PDAL is a C++ library for translating and manipulating point cloud data.
PDT PDT/3.25.1
PDT/3.25.2
Program Database Toolkit (PDT) is a framework for analyzing source code written in several programming languages and for making rich program knowledge accessible to developers of static and dynamic analysis tools. PDT implements a standard program representation, the program database (PDB), that can be accessed in a uniform way through a class library supporting common PDB operations.
PETSC PETSc/3.15.1
PETSc/3.17.4
PETSc/3.19.2
PETSc/3.19.2-64bit
PETSc/3.20.3
PETSc/20231020-CUDA-11.8.0
PETSc/20231023-CUDA-11.8.0
PETSc/20231110-CUDA-11.8.0
PETSc, pronounced PET-see (the S is silent), is a suite of data structures and routines for the scalable (parallel) solution of scientific applications modeled by partial differential equations.
PFFT PFFT/20181230 PFFT is a software library for computing massively parallel, fast Fourier transformations on distributed memory architectures. PFFT can be understood as a generalization of FFTW-MPI to multidimensional data decomposition. The library is written in C and MPI. A Fortran interface is also available. Support for hybrid parallelization based on OpenMP and MPI is under development.
PHYLIP PHYLIP/3.697 PHYLIP is a free package of programs for inferring phylogenies.
PLINK PLINK/2.00a3.7 PLINK is a free, open-source whole genome association analysis toolset, designed to perform a range of basic, large-scale analyses in a computationally efficient manner.
PLUMED PLUMED/2.7.2
PLUMED/2.7.3
PLUMED/2.8.0
PLUMED/2.8.1
PLUMED/2.9.0
PLUMED/2.9.2
PLUMED/2.9.3
PLUMED is an open source library for free energy calculations in molecular systems which works together with some of the most popular molecular dynamics engines. Free energy calculations can be performed as a function of many order parameters with a particular focus on biological problems, using state of the art methods such as metadynamics, umbrella sampling and Jarzynski-equation based steered MD. The software, written in C++, can be easily interfaced with both fortran and C/C++ codes.
PMIX PMIx/3.1.5
PMIx/3.2.3
PMIx/4.1.0
PMIx/4.1.2
PMIx/4.2.2
PMIx/4.2.4
PMIx/4.2.5
PMIx/4.2.6
PMIx/5.0.1
PMIx/5.0.2
Process Management for Exascale Environments PMI Exascale (PMIx) represents an attempt to provide an extended version of the PMI standard specifically designed to support clusters up to and including exascale sizes. The overall objective of the project is not to branch the existing pseudo-standard definitions - in fact, PMIx fully supports both of the existing PMI-1 and PMI-2 APIs - but rather to (a) augment and extend those APIs to eliminate some current restrictions that impact scalability, and (b) provide a reference implementation of the PMI-server that demonstrates the desired level of scalability.
POV-RAY POV-Ray/3.7.0.10 The Persistence of Vision Raytracer, or POV-Ray, is a ray tracing program which generates images from a text-based scene description, and is available for a variety of computer platforms. POV-Ray is a high-quality, Free Software tool for creating stunning three-dimensional graphics. The source code is available for those wanting to do their own ports.
PRANK PRANK/170427 PRANK is a probabilistic multiple alignment program for DNA, codon and amino-acid sequences. PRANK is based on a novel algorithm that treats insertions correctly and avoids over-estimation of the number of deletion events.
PROJ PROJ/7.2.1
PROJ/8.0.1
PROJ/8.1.0
PROJ/9.0.0
PROJ/9.1.1
PROJ/9.2.0
PROJ/9.3.1
Program proj is a standard Unix filter function which converts geographic longitude and latitude coordinates into cartesian coordinates
PRRTE PRRTE/3.0.2
PRRTE/3.0.5
The PMIx Reference Runtime Environment is a reference run-time environment that utilizes the PMIx API. It mainly provides run-time environment infrastructure for environments that do not natively have them. In practical terms, this typically means providing infrastructure for non-scheduled environments that have no concept of distributed scheduling, file staging, remote stdout/stderr redirection, and only have ssh to execute commands on remote nodes.
PYTHIA PYTHIA/8.309 PYTHIA is a program for the generation of high-energy physics collision events, i.e. for the description of collisions at high energies between electrons, protons, photons and heavy nuclei. It contains theory and models for a number of physics aspects, including hard and soft interactions, parton distributions, initial- and final-state parton showers, multiparton interactions, fragmentation and decay. It is largely based on original research, but also borrows many formulae and other knowledge from the literature. As such it is categorized as a general purpose Monte Carlo event generator.
PADICOTM PadicoTM/20220531 PM2 is an umbrella software suite for high-performance runtime systems. Modules may be installed and used together or separately.
PANDOC Pandoc/3.1.2 If you need to convert files from one markup format into another, pandoc is your swiss-army knife
PANGO Pango/1.48.5
Pango/1.48.8
Pango/1.50.7
Pango/1.50.12
Pango/1.50.14
Pango/1.51.0
Pango is a library for laying out and rendering of text, with an emphasis on internationalization. Pango can be used anywhere that text layout is needed, though most of the work on Pango so far has been done in the context of the GTK+ widget toolkit. Pango forms the core of text and font handling for GTK+-2.x.
PARMETIS ParMETIS/4.0.3 ParMETIS is an MPI-based parallel library that implements a variety of algorithms for partitioning unstructured graphs, meshes, and for computing fill-reducing orderings of sparse matrices. ParMETIS extends the functionality provided by METIS and includes routines that are especially suited for parallel AMR computations and large scale numerical simulations. The algorithms implemented in ParMETIS are based on the parallel multilevel k-way graph-partitioning, adaptive repartitioning, and parallel multi-constrained partitioning schemes.
PARAFOLD ParaFold/2.0-CUDA-11.8.0 This project is a modified version of DeepMind's AlphaFold2 to achieve high-throughput protein structure prediction.
PARAVIEW ParaView/5.11.1-MPI-Linux64
ParaView/5.11.1
ParaView/5.11.2
ParaView/5.12.0-MPI-Linux64
ParaView is the world’s leading open source post-processing visualization engine.
PARABRICKS Parabricks/4.1.1 Clara Parabricks is a GPU-accelerated software suite for performing secondary analysis of next generation sequencing DNA and RNA data.
PARSL Parsl/2023.7.17 Parsl extends parallelism in Python beyond a single computer. You can use Parsl just like Python's parallel executors but across multiple cores and nodes. However, the real power of Parsl is in expressing multi-step workflows of functions. Parsl lets you chain functions together and will launch each function as inputs and computing resources are available.
PERL Perl/5.32.0-minimal
Perl/5.32.0
Perl/5.32.1-minimal
Perl/5.32.1
Perl/5.34.0-minimal
Perl/5.34.0
Perl/5.34.1-minimal
Perl/5.34.1
Perl/5.36.0-minimal
Perl/5.36.0
Perl/5.36.1
Perl/5.38.0
Perl/5.38.2
Larry Wall's Practical Extraction and Report Language This is a minimal build without any modules. Should only be used for build dependencies.
PERL-BUNDLE-CPAN Perl-bundle-CPAN/5.36.1
Perl-bundle-CPAN/5.38.0
Perl-bundle-CPAN/5.38.2
A set of common packages from CPAN
PERL-BUNDLE1-CPAN Perl-bundle1-CPAN/5.36.1 A set of common packages from CPAN
PERL-BUNDLE2-CPAN Perl-bundle2-CPAN/5.36.1 A set of common packages from CPAN
PILLOW Pillow/8.0.1
Pillow/8.2.0
Pillow/8.3.2
Pillow/9.1.1
Pillow/9.4.0
Pillow/10.0.0
Pillow/10.2.0
Pillow is the 'friendly PIL fork' by Alex Clark and Contributors. PIL is the Python Imaging Library by Fredrik Lundh and Contributors.
PILLOW-SIMD Pillow-SIMD/8.2.0
Pillow-SIMD/9.2.0
Pillow-SIMD/9.5.0
Pillow is the 'friendly PIL fork' by Alex Clark and Contributors. PIL is the Python Imaging Library by Fredrik Lundh and Contributors.
PNETCDF PnetCDF/1.12.3
PnetCDF/1.13.0
Parallel netCDF: A Parallel I/O Library for NetCDF File Access
PORTMIDI PortMidi/2.0.4 PortMidi is a library for software developers. It supports real-time input and output of MIDI data using a system-independent interface. PortMidi runs on Windows (using MME), Macintosh (using CoreMIDI), and Linux (using ALSA).
POSTGRESQL PostgreSQL/13.4
PostgreSQL/15.2
PostgreSQL/16.1
PostgreSQL is a powerful, open source object-relational database system. It is fully ACID compliant, has full support for foreign keys, joins, views, triggers, and stored procedures (in multiple languages). It includes most SQL:2008 data types, including INTEGER, NUMERIC, BOOLEAN, CHAR, VARCHAR, DATE, INTERVAL, and TIMESTAMP. It also supports storage of binary large objects, including pictures, sounds, or video. It has native programming interfaces for C/C++, Java, .Net, Perl, Python, Ruby, Tcl, ODBC, among others, and exceptional documentation.
PTEX Ptex/2.4.2 Ptex is a texture mapping system developed by Walt Disney Animation Studios for production-quality rendering.
PUK Puk/20220531 PM2 is an umbrella software suite for high-performance runtime systems. Modules may be installed and used together or separately.
PUKABI PukABI/20220531 PM2 is an umbrella software suite for high-performance runtime systems. Modules may be installed and used together or separately.
PYBIOLIB PyBioLib/1.1.988 PyBioLib is a Python package for running BioLib applications from Python scripts and the command line. BioLib is a library of biological data science applications. Applications on BioLib range from small bioinformatics utilities to state-of-the-art machine learning algorithms for predicting characteristics of biological molecules.
PYCUDA PyCUDA/2022.2.2-CUDA-11.8.0 PyCUDA lets you access Nvidia’s CUDA parallel computation API from Python.
PYCAIRO PyCairo/1.21.0
PyCairo/1.25.0
Python bindings for the cairo library
PYFR PyFR/1.15.0-Python-3.11.5-CUDA-11.8.0
PyFR/2.0.0
PyFR is an open-source Python based framework for solving advection-diffusion type problems on streaming architectures using the Flux Reconstruction approach of Huynh. The framework is designed to solve a range of governing systems on mixed unstructured grids containing various element types. It is also designed to target a range of hardware platforms via use of an in-built domain specific language derived from the Mako templating engine.
PYGOBJECT PyGObject/3.42.1
PyGObject/3.46.0
PyGObject is a Python package which provides bindings for GObject based libraries such as GTK, GStreamer, WebKitGTK, GLib, GIO and many more.
PYOPENGL PyOpenGL/3.1.6
PyOpenGL/3.1.7
PyOpenGL is the most common cross platform Python binding to OpenGL and related APIs.
PYQT5 PyQt5/5.15.4 PyQt5 is a set of Python bindings for v5 of the Qt application framework from The Qt Company. This bundle includes PyQtWebEngine, a set of Python bindings for The Qt Company’s Qt WebEngine framework.
PYROSETTA PyRosetta/4.release-387 PyRosetta is an interactive Python-based interface to the powerful Rosetta molecular modeling suite. It enables users to design their own custom molecular modeling algorithms using Rosetta sampling methods and energy functions.
PYTENSOR PyTensor/2.17.1 Optimizing compiler for evaluating mathematical expressions on CPUs and GPUs
PYTORCH PyTorch/1.10.0-CUDA-11.3.1
PyTorch/1.12.0-CUDA-11.7.0
PyTorch/1.12.0
PyTorch/1.12.1-CUDA-11.3.1
PyTorch/1.12.1-CUDA-11.7.0
PyTorch/1.13.1-CUDA-11.7.0
PyTorch/1.13.1
PyTorch/2.1.2-CUDA-12.1.1
PyTorch/2.1.2
PyTorch/2.7.0-CUDA-12.6.0
Tensors and Dynamic neural networks in Python with strong GPU acceleration. PyTorch is a deep learning framework that puts Python first.
PYTORCH-GEOMETRIC PyTorch-Geometric/2.1.0-PyTorch-1.12.0-CUDA-11.7.0 PyTorch Geometric (PyG) is a geometric deep learning extension library for PyTorch.
PYTORCH-LIGHTNING PyTorch-Lightning/1.5.9-CUDA-11.3.1
PyTorch-Lightning/1.7.7-CUDA-11.7.0
PyTorch-Lightning/1.8.4-CUDA-11.7.0
PyTorch-Lightning/1.8.4
PyTorch-Lightning/2.2.1-CUDA-12.1.1
PyTorch Lightning is the lightweight PyTorch wrapper for ML researchers.
PYTORCH-BUNDLE PyTorch-bundle/2.1.2-CUDA-12.1.1 PyTorch with compatible versions of official Torch extensions.
PYYAML PyYAML/5.3.1
PyYAML/5.4.1
PyYAML/6.0
PyYAML/6.0.1
PyYAML is a YAML parser and emitter for the Python programming language.
PYZMQ PyZMQ/24.0.1
PyZMQ/25.1.1
PyZMQ/25.1.2
Python bindings for ZeroMQ
PYCURL PycURL/7.45.2 PycURL is a Python interface to libcurl. PycURL can be used to fetch objects identified by a URL from a Python program, similar to the urllib Python module. PycURL is mature, very fast, and supports a lot of features.
PYSAM Pysam/0.18.0
Pysam/0.19.1
Pysam/0.20.0
Pysam/0.21.0
Pysam/0.22.0
Pysam/0.22.1
Pysam is a python module for reading and manipulating Samfiles. It's a lightweight wrapper of the samtools C-API. Pysam also includes an interface for tabix.
PYTHON Python/2.7.18-bare
Python/2.7.18
Python/3.8.6
Python/3.9.5-bare
Python/3.9.5
Python/3.9.6-bare
Python/3.9.6
Python/3.10.4-bare
Python/3.10.4
Python/3.10.8-bare
Python/3.10.8
Python/3.11.3
Python/3.11.5
Python/3.12.3
Python is a programming language that lets you work more quickly and integrate your systems more effectively.
PYTHON-BUNDLE-PYPI Python-bundle-PyPI/2023.06
Python-bundle-PyPI/2023.10
Python-bundle-PyPI/2024.06
Bundle of Python packages from PyPI
QCA QCA/2.3.5 Taking a hint from the similarly-named Java Cryptography Architecture, QCA aims to provide a straightforward and cross-platform crypto API, using Qt datatypes and conventions. QCA separates the API from the implementation, using plugins known as Providers. The advantage of this model is to allow applications to avoid linking to or explicitly depending on any particular cryptographic library. This allows one to easily change or upgrade crypto implementations without even needing to recompile the application! QCA should work everywhere Qt does, including Windows/Unix/MacOSX.
QEMU QEMU/9.0.2 A generic and open source machine emulator and virtualizer.
QGIS QGIS/3.28.1 QGIS is a user friendly Open Source Geographic Information System (GIS)
QIIME2 QIIME2/2022.11
QIIME2/2023.7.0
QIIME2/2024.10-Amplicon-itsxpress
QIIME2/2024.10-Amplicon
QIIME2/2024.10-Pathogenome
QIIME2/2024.10-Metagenome
QIIME is an open-source bioinformatics pipeline for performing microbiome analysis from raw DNA sequencing data.
QJSON QJson/0.9.0 QJson is a Qt-based library that maps JSON data to QVariant objects and vice versa.
QSCINTILLA QScintilla/2.11.6 QScintilla is a port to Qt of Neil Hodgson's Scintilla C++ editor control
QUAST QUAST/5.2.0 QUAST evaluates genome assemblies by computing various metrics. It works both with and without reference genomes. The tool accepts multiple assemblies, thus is suitable for comparison.
QUDA QUDA/20250226-f0e46e4-CUDA-12.2.0-magma-2.7.2
QUDA/20250226-f0e46e4-CUDA-12.2.0
QUDA is a library for performing calculations in lattice QCD on graphics processing units (GPUs), leveraging NVIDIA's CUDA platform.
QHULL Qhull/2020.2 Qhull computes the convex hull, Delaunay triangulation, Voronoi diagram, halfspace intersection about a point, furthest-site Delaunay triangulation, and furthest-site Voronoi diagram. The source code runs in 2-d, 3-d, 4-d, and higher dimensions. Qhull implements the Quickhull algorithm for computing the convex hull.
QISKIT Qiskit/2.0.2 Qiskit is an open-source SDK for working with quantum computers at the level of extended quantum circuits, operators, and primitives.
QT5 Qt5/5.15.2
Qt5/5.15.5
Qt5/5.15.7
Qt5/5.15.10
Qt5/5.15.13
Qt is a comprehensive cross-platform C++ application framework.
QT5WEBKIT Qt5Webkit/5.212.0-alpha4 Qt Port of WebKit. WebKit is an open source web browser engine.
QT6 Qt6/6.6.3 Qt is a comprehensive cross-platform C++ application framework.
QTKEYCHAIN QtKeychain/0.13.2 Platform-independent Qt API for storing passwords securely.
QUANTUMESPRESSO QuantumESPRESSO/7.1
QuantumESPRESSO/7.2
QuantumESPRESSO/7.3.1
QuantumESPRESSO/7.4.1-Environ-3.1
QuantumESPRESSO/7.4.1-NVHPC-24.9-CUDA-12.6.0
Quantum ESPRESSO is an integrated suite of computer codes for electronic-structure calculations and materials modeling at the nanoscale. It is based on density-functional theory, plane waves, and pseudopotentials (both norm-conserving and ultrasoft).
QWT Qwt/6.2.0 The Qwt library contains GUI Components and utility classes which are primarily useful for programs with a technical background.
R R/4.1.0
R/4.2.0
R/4.2.1-stub
R/4.2.1
R/4.2.2
R/4.3.1
R/4.3.2
R/4.3.3
R/4.4.1
R is a free software environment for statistical computing and graphics.
R-BUNDLE-BIOCONDUCTOR R-bundle-Bioconductor/3.15-R-4.2.1 Bioconductor provides tools for the analysis and coprehension of high-throughput genomic data.
R-BUNDLE-CRAN R-bundle-CRAN/2023.12 Bundle of R packages from CRAN
RAPIDS RAPIDS/23.08 Built based on the Apache Arrow columnar memory format, cuDF is a GPU DataFrame library for loading, joining, aggregating, filtering, and otherwise manipulating data.
RAPSEARCH2 RAPSearch2/2.24 RAPSearch stands for Reduced Alphabet based Protein similarity Search
RDFLIB RDFlib/5.0.0
RDFlib/6.2.0
RDFLib is a Python library for working with RDF, a simple yet powerful language for representing information.
RDKIT RDKit/2022.09.4 RDKit is a collection of cheminformatics and machine-learning software written in C++ and Python.
RE2 RE2/2022-06-01
RE2/2023-03-01
RE2/2023-08-01
RE2/2024-03-01
RE2/2024-07-02
re2/2023-11-01
RE2 is a fast, safe, thread-friendly alternative to backtracking regular expression engines like those used in PCRE, Perl, and Python. It is a C++ library.
ROOT ROOT/6.26.06
ROOT/6.26.10
The ROOT system provides a set of OO frameworks with all the functionality needed to handle and analyze large amounts of data in a very efficient way.
RSEM RSEM/1.3.3 RNA-Seq by Expectation-Maximization
RACON Racon/1.5.0 Ultrafast consensus module for raw de novo genome assembly of long uncorrected reads.
RAPIDJSON RapidJSON/1.1.0
RapidJSON/1.1.0-20230928
RapidJSON/1.1.0-20240409
A fast JSON parser/generator for C++ with both SAX/DOM style API
RAVEN Raven/1.8.1 Raven is a de novo genome assembler for long uncorrected reads.
RAY-PROJECT Ray-project/2.2.0
Ray-project/2.6.2
Ray is a fast and simple framework for building and running distributed applications.
REFRAME ReFrame/4.0.5 ReFrame is a framework for writing regression tests for HPC systems.
REDIS Redis/7.0.8 Redis is an open source (BSD licensed), in-memory data structure store, used as a database, cache, and message broker. Redis provides data structures such as strings, hashes, lists, sets, sorted sets with range queries, bitmaps, hyperloglogs, geospatial indexes, and streams. Redis has built-in replication, Lua scripting, LRU eviction, transactions, and different levels of on-disk persistence, and provides high availability via Redis Sentinel and automatic partitioning with Redis Cluster.
ROSETTA Rosetta/3.14-mpi
Rosetta/3.14
Rosetta is the premier software suite for modeling macromolecular structures. As a flexible, multi-purpose application, it includes tools for structure prediction, design, and remodeling of proteins and nucleic acids.
RUBY Ruby/3.0.1
Ruby/3.0.3
Ruby/3.3.0
Ruby is a dynamic, open source programming language with a focus on simplicity and productivity. It has an elegant syntax that is natural to read and easy to write.
RUST Rust/1.52.1
Rust/1.54.0
Rust/1.60.0
Rust/1.65.0
Rust/1.70.0
Rust/1.73.0
Rust/1.75.0
Rust/1.76.0
Rust/1.78.0
Rust/1.81.0
Rust/1.82.0
Rust is a systems programming language that runs blazingly fast, prevents segfaults, and guarantees thread safety.
SAMTOOLS SAMtools/1.11
SAMtools/1.14
SAMtools/1.16.1
SAMtools/1.17
SAMtools/1.18
SAMtools/1.22
SAM Tools provide various utilities for manipulating alignments in the SAM format, including sorting, merging, indexing and generating alignments in a per-position format.
SCOTCH SCOTCH/6.1.0
SCOTCH/6.1.2
SCOTCH/7.0.1
SCOTCH/7.0.3
SCOTCH/7.0.4
Software package and libraries for sequential and parallel graph partitioning, static mapping, and sparse matrix block ordering, and sequential mesh and hypergraph partitioning.
SCONS SCons/4.4.0 SCons is a software construction tool.
SDL2 SDL2/2.0.20
SDL2/2.0.22
SDL2/2.26.3
SDL2/2.28.2
SDL2/2.28.5
SDL2/2.30.6
SDL: Simple DirectMedia Layer, a cross-platform multimedia library
SDL2_IMAGE SDL2_image/2.8.2 This is a simple library to load images of various formats as SDL surfaces. It can load BMP, GIF, JPEG, LBM, PCX, PNG, PNM (PPM/PGM/PBM), QOI, TGA, XCF, XPM, and simple SVG format images. It can also load AVIF, JPEG-XL, TIFF, and WebP images, depending on build options (see the note below for details.)
SDL2_MIXER SDL2_mixer/2.8.0 Due to popular demand, here is a simple multi-channel audio mixer. It supports 8 channels of 16 bit stereo audio, plus a single channel of music. It can load FLAC, MP3, Ogg, VOC, and WAV format audio. It can also load MIDI, MOD, and Opus audio, depending on build options (see the note below for details.)
SDL2_TTF SDL2_ttf/2.22.0 This library is a wrapper around the FreeType and Harfbuzz libraries, allowing you to use TrueType fonts to render text in SDL applications.
SEPP SEPP/4.5.1 SATe-enabled Phylogenetic Placement - addresses the problem of phylogenetic placement of short reads into reference alignments and trees.
SHAP SHAP/0.41.0 SHAP (SHapley Additive exPlanations) is a game theoretic approach to explain the output of any machine learning model. It connects optimal credit allocation with local explanations using the classic Shapley values from game theory and their related extensions.
SIONLIB SIONlib/1.7.7-tools
SIONlib/1.7.7
SIONlib is a scalable I/O library for parallel access to task-local files. The library not only supports writing and reading binary data to or from several thousands of processors into a single or a small number of physical files, but also provides global open and close functions to access SIONlib files in parallel. This package provides a stripped-down installation of SIONlib for use with performance tools (e.g., Score-P), with renamed symbols to avoid conflicts when an application using SIONlib itself is linked against a tool requiring a different SIONlib version.
SLEPC SLEPc/3.15.1
SLEPc/3.17.2
SLEPc (Scalable Library for Eigenvalue Problem Computations) is a software library for the solution of large scale sparse eigenvalue problems on parallel computers. It is an extension of PETSc and can be used for either standard or generalized eigenproblems, with real or complex arithmetic. It can also be used for computing a partial SVD of a large, sparse, rectangular matrix, and to solve quadratic eigenvalue problems.
SPADES SPAdes/3.15.3
SPAdes/3.15.5
Genome assembler for single-cell and isolates data sets
SQLALCHEMY SQLAlchemy/2.0.25 SQLAlchemy is the Python SQL toolkit and Object Relational Mapper that gives application developers the full power and flexibility of SQL. SQLAlchemy provides a full suite of well known enterprise-level persistence patterns, designed for efficient and high-performing database access, adapted into a simple and Pythonic domain language.
SQLITE SQLite/3.33.0
SQLite/3.35.4
SQLite/3.36
SQLite/3.38.3
SQLite/3.39.4
SQLite/3.42.0
SQLite/3.43.1
SQLite/3.44.0
SQLite/3.45.3
SQLite: SQL Database Engine in a C Library
SRA-TOOLKIT SRA-Toolkit/3.0.3
SRA-Toolkit/3.0.5
The SRA Toolkit, and the source-code SRA System Development Kit (SDK), will allow you to programmatically access data housed within SRA and convert it from the SRA format
SSW SSW/1.1 SSW is a fast implementation of the Smith-Waterman algorithm, which uses the Single-Instruction Multiple-Data (SIMD) instructions to parallelize the algorithm at the instruction level. SSW library provides an API that can be flexibly used by programs written in C, C++ and other languages. We also provide a software that can do protein and genome alignment directly. Current version of our implementation is ~50 times faster than an ordinary Smith-Waterman. It can return the Smith-Waterman score, alignment location and traceback path (cigar) of the optimal alignment accurately; and return the sub-optimal alignment score and location heuristically.
STAR STAR/2.7.2b
STAR/2.7.10b
STAR/2.7.11a
STAR aligns RNA-seq reads to a reference genome using uncompressed suffix arrays.
SUNDIALS SUNDIALS/6.3.0 SUNDIALS: SUite of Nonlinear and DIfferential/ALgebraic Equation Solvers
SWIG SWIG/4.0.2
SWIG/4.1.1
SWIG is a software development tool that connects programs written in C and C++ with a variety of high-level programming languages.
SAFETENSORS Safetensors/0.4.3 Safetensors is a new simple format for storing tensors safely (as opposed to pickle) and that is still fast (zero-copy). Safetensors is really fast. This variant of Safetensors is installed with support for numpy and PyTorch
SALMON Salmon/1.9.0 Salmon is a wicked-fast program to produce a highly-accurate, transcript-level quantification estimates from RNA-seq data.
SCAFACOS ScaFaCoS/1.0.1
ScaFaCoS/1.0.4
ScaFaCoS is a library of scalable fast coulomb solvers.
SCALAPACK ScaLAPACK/2.1.0-fb
ScaLAPACK/2.1.0
ScaLAPACK/2.2.0-fb
The ScaLAPACK (or Scalable LAPACK) library includes a subset of LAPACK routines redesigned for distributed memory MIMD parallel computers.
SCALASCA Scalasca/2.6.1 Scalasca is a software tool that supports the performance optimization of parallel programs by measuring and analyzing their runtime behavior. The analysis identifies potential performance bottlenecks -- in particular those concerning communication and synchronization -- and offers guidance in exploring their causes.
SCALENE Scalene/1.5.26 Scalene is a high-performance CPU, GPU and memory profiler for Python that does a number of things that other Python profilers do not and cannot do. It runs orders of magnitude faster than other profilers while delivering far more detailed information.
SCHRODINGER Schrodinger/2023-4 Schrodinger software is a physics-based computational platform that integrates differentiated solutions for predictive modeling, data analytics, and collaboration to enable rapid exploration of chemical space.
SCIPY-BUNDLE SciPy-bundle/2020.11
SciPy-bundle/2021.05
SciPy-bundle/2021.10
SciPy-bundle/2022.05
SciPy-bundle/2023.02
SciPy-bundle/2023.07
SciPy-bundle/2023.11
Bundle of Python packages for scientific software
SCORE-P Score-P/8.3
Score-P/8.4
The Score-P measurement infrastructure is a highly scalable and easy-to-use tool suite for profiling, event tracing, and online analysis of HPC applications.
SEABORN Seaborn/0.12.1
Seaborn/0.13.2
Seaborn is a Python visualization library based on matplotlib. It provides a high-level interface for drawing attractive statistical graphics.
SENTENCEPIECE SentencePiece/0.1.97
SentencePiece/0.2.0
Unsupervised text tokenizer for Neural Network-based text generation.
SEQLIB SeqLib/1.2.0 C++ interface to HTSlib, BWA-MEM and Fermi.
SERF Serf/1.3.9 The serf library is a high performance C-based HTTP client library built upon the Apache Portable Runtime (APR) library
SHAPELY Shapely/1.8.2
Shapely/2.0.1
Shapely is a BSD-licensed Python package for manipulation and analysis of planar geometric objects. It is based on the widely deployed GEOS (the engine of PostGIS) and JTS (from which GEOS is ported) libraries.
SOX SoX/14.4.2 Sound eXchange, the Swiss Army knife of audio manipulation
SPFFT SpFFT/1.1.0 Sparse 3D FFT library with MPI, OpenMP, CUDA and ROCm support.
SPACK Spack/0.21.2 Spack is a package manager for supercomputers, Linux, and macOS. It makes installing scientific software easy. With Spack, you can build a package with multiple versions, configurations, platforms, and compilers, and all of these builds can coexist on the same machine.
SPARK Spark/3.5.1-Java-17 Spark is Hadoop MapReduce done in memory
STARPU StarPU/1.3.11 PM2 is an umbrella software suite for high-performance runtime systems. Modules may be installed and used together or separately.
SUBVERSION Subversion/1.14.2 Subversion is an open source version control system.
SUITESPARSE SuiteSparse/5.10.1-METIS-5.1.0
SuiteSparse/5.13.0-METIS-5.1.0
SuiteSparse/7.1.0
SuiteSparse/7.7.0-METIS-5.1.0
SuiteSparse/7.8.2-METIS-5.1.0
SuiteSparse is a collection of libraries manipulate sparse matrices.
SUPERLU SuperLU/6.0.1 SuperLU is a general purpose library for the direct solution of large, sparse, nonsymmetric systems of linear equations on high performance machines.
SUPERLU_DIST SuperLU_DIST/8.1.0
SuperLU_DIST/8.1.2
SuperLU_DIST/8.2.1
SuperLU is a general purpose library for the direct solution of large, sparse, nonsymmetric systems of linear equations on high performance machines.
SZIP Szip/2.1.1 Szip compression software, providing lossless compression of scientific data
TCL Tcl/8.6.10
Tcl/8.6.11
Tcl/8.6.12
Tcl/8.6.13
Tcl/8.6.14
Tcl (Tool Command Language) is a very powerful but easy to learn dynamic programming language, suitable for a very wide range of uses, including web and desktop applications, networking, administration, testing and many more.
TENSORFLOW TensorFlow/2.5.0
TensorFlow/2.5.3-CUDA-11.3.1
TensorFlow/2.6.0-CUDA-11.3.1
TensorFlow/2.7.1-CUDA-11.4.1
TensorFlow/2.8.4
TensorFlow/2.11.0-CUDA-11.7.0
TensorFlow/2.13.0-CUDA-11.8.0
TensorFlow/2.13.0
An open-source software library for Machine Intelligence
TENSORRT TensorRT/8.6.0.12-CUDA-11
TensorRT/8.6.0.12-CUDA-12
TensorRT/8.6.1.6-CUDA-11
TensorRT/8.6.1.6-CUDA-12
An SDK for high-performance deep learning inference, includes a deep learning inference optimizer and runtime that delivers low latency and high throughput for inference applications.
THEANO Theano/1.1.2-PyMC Theano is a Python library that allows you to define, optimize, and evaluate mathematical expressions involving multi-dimensional arrays efficiently.
TK Tk/8.6.10
Tk/8.6.11
Tk/8.6.12
Tk/8.6.13
Tk/8.6.14
Tk is an open source, cross-platform widget toolchain that provides a library of basic elements for building a graphical user interface (GUI) in many different programming languages.
TKINTER Tkinter/3.8.6
Tkinter/3.9.5
Tkinter/3.9.6
Tkinter/3.10.4
Tkinter/3.10.8
Tkinter/3.11.3
Tkinter/3.11.5
Tkinter module, built with the Python buildsystem
TRANSDECODER TransDecoder/5.5.0 TransDecoder identifies candidate coding regions within transcript sequences, such as those generated by de novo RNA-Seq transcript assembly using Trinity, or constructed based on RNA-Seq alignments to the genome using Tophat and Cufflinks.
TRANSFORMERS Transformers/4.39.3 State-of-the-art Natural Language Processing for PyTorch and TensorFlow 2.0
TRANSRATE Transrate/1.0.3 Transrate is software for de-novo transcriptome assembly quality analysis. It examines your assembly in detail and compares it to experimental evidence such as the sequencing reads, reporting quality scores for contigs and assemblies. This allows you to choose between assemblers and parameters, filter out the bad contigs from an assembly, and help decide when to stop trying to improve the assembly.
TRILINOS Trilinos/13.4.1 The Trilinos Project is an effort to develop algorithms and enabling technologies within an object-oriented software framework for the solution of large-scale, complex multi-physics engineering and scientific problems. A unique design feature of Trilinos is its focus on packages.
TRIM_GALORE Trim_Galore/0.6.10 Trim Galore! is a wrapper script to automate quality and adapter trimming as well as quality control, with some added functionality to remove biased methylation positions for RRBS sequence files (for directional, non-directional (or paired-end) sequencing).
TRIMMOMATIC Trimmomatic/0.39-Java-17 Trimmomatic performs a variety of useful trimming tasks for illumina paired-end and single ended data.The selection of trimming steps and their associated parameters are supplied on the command line.
TRINITY Trinity/2.15.1 Trinity represents a novel method for the efficient and robust de novo reconstruction of transcriptomes from RNA-Seq data. Trinity combines three independent software modules: Inchworm, Chrysalis, and Butterfly, applied sequentially to process large volumes of RNA-Seq reads.
TRINOTATE Trinotate/4.0.1 Trinotate is a comprehensive annotation suite designed for automatic functional annotation of transcriptomes, particularly de novo assembled transcriptomes, from model or non-model organisms. Trinotate makes use of a number of different well referenced methods for functional annotation including homology search to known sequence data (BLAST+/SwissProt), protein domain identification (HMMER/PFAM), protein signal peptide and transmembrane domain prediction (signalP/tmHMM), and leveraging various annotation databases (eggNOG/GO/Kegg databases). All functional annotation data derived from the analysis of transcripts is integrated into a SQLite database which allows fast efficient searching for terms with specific qualities related to a desired scientific hypothesis or a means to create a whole annotation report for a transcriptome.
TRITON Triton/1.1.1-CUDA-11.7.0 Triton is a language and compiler for parallel programming. It aims to provide a Python-based programming environment for productively writing custom DNN compute kernels capable of running at maximal throughput on modern GPU hardware.
TWISTED Twisted/22.4.0 Twisted is an event-based framework for internet applications, supporting Python 3.6+.
UCC UCC/1.0.0
UCC/1.1.0
UCC/1.2.0
UCC/1.3.0
UCC (Unified Collective Communication) is a collective communication operations API and library that is flexible, complete, and feature-rich for current and emerging programming models and runtimes.
UCC-CUDA UCC-CUDA/1.0.0-CUDA-11.7.0
UCC-CUDA/1.1.0-CUDA-12.0.0
UCC-CUDA/1.3.0-CUDA-12.6.0
UCC (Unified Collective Communication) is a collective communication operations API and library that is flexible, complete, and feature-rich for current and emerging programming models and runtimes. This module adds the UCC CUDA support.
UCX UCX/1.9.0-CUDA-11.1.1
UCX/1.9.0
UCX/1.10.0
UCX/1.11.2
UCX/1.12.1
UCX/1.13.1
UCX/1.14.0
UCX/1.14.1
UCX/1.15.0-rc4
UCX/1.15.0-CUDA-12.5.0
UCX/1.15.0
UCX/1.16.0
Unified Communication X An open-source production grade communication framework for data centric and high-performance applications
UCX-CUDA UCX-CUDA/1.10.0-CUDA-11.3.1
UCX-CUDA/1.11.2-CUDA-11.4.1
UCX-CUDA/1.12.1-CUDA-11.7.0
UCX-CUDA/1.12.1-CUDA-11.8.0
UCX-CUDA/1.12.1-CUDA-12.2.0
UCX-CUDA/1.13.1-CUDA-12.0.0
UCX-CUDA/1.14.1-CUDA-11.8.0
UCX-CUDA/1.14.1-CUDA-12.1.1
UCX-CUDA/1.14.1-CUDA-12.2.0
UCX-CUDA/1.15.0-rc4-CUDA-12.4.1
UCX-CUDA/1.15.0-CUDA-12.2.0
UCX-CUDA/1.15.0-CUDA-12.2.2
UCX-CUDA/1.15.0-CUDA-12.3.0
UCX-CUDA/1.15.0-CUDA-12.4.0
UCX-CUDA/1.15.0-CUDA-12.4.1
UCX-CUDA/1.15.0-CUDA-12.5.0
UCX-CUDA/1.16.0-CUDA-12.6.0
Unified Communication X An open-source production grade communication framework for data centric and high-performance applications This module adds the UCX CUDA support.
UDUNITS UDUNITS/2.2.26
UDUNITS/2.2.28
UDUNITS supports conversion of unit specifications between formatted and binary forms, arithmetic manipulation of units, and conversion of values between compatible scales of measurement.
UNZIP UnZip/6.0 UnZip is an extraction utility for archives compressed in .zip format (also called "zipfiles"). Although highly compatible both with PKWARE's PKZIP and PKUNZIP utilities for MS-DOS and with Info-ZIP's own Zip program, our primary objectives have been portability and non-MSDOS functionality.
UNI-CORE Uni-Core/0.0.3-CUDA-11.7.0 An efficient distributed PyTorch framework
UNIFRAC UniFrac/1.3.2 UniFrac is the de facto repository for high-performance phylogenetic diversity calculations. The methods in this repository are based on an implementation of the Strided State UniFrac algorithm which is faster, and uses less memory than Fast UniFrac. Strided State UniFrac supports Unweighted UniFrac, Weighted UniFrac, Generalized UniFrac, Variance Adjusted UniFrac and meta UniFrac, in both double and single precision (fp32). This repository also includes Stacked Faith (manuscript in preparation), a method for calculating Faith's PD that is faster and uses less memory than the Fast UniFrac-based reference implementation.
UNICYCLER Unicycler/0.5.0 Unicycler is an assembly pipeline for bacterial genomes. It can assemble Illumina-only read sets where it functions as a SPAdes-optimiser. It can also assembly long-read-only sets (PacBio or Nanopore) where it runs a miniasm+Racon pipeline.
VCFTOOLS VCFtools/0.1.16 The aim of VCFtools is to provide easily accessible methods for working with complex genetic variation data in the form of VCF files.
VESTA VESTA/3.5.8-gtk3 VESTA is a 3D visualization program for structured models, volumetric data such as electron/nuclear densities, and crystal morphologies.
VMD VMD/1.9.4a57 VMD is a molecular visualization program for displaying, animating, and analyzing large biomolecular systems using 3-D graphics and built-in scripting.
VSCODE VSCode/1.85.0 Visual Studio Code is a lightweight but powerful source code editor which runs on your desktop and is available for Windows, macOS and Linux. It comes with built-in support for JavaScript, TypeScript and Node.js and has a rich ecosystem of extensions for other languages and runtimes (such as C++, C#, Java, Python, PHP, Go, .NET). Begin your journey with VS Code with these introductory videos.
VSEARCH VSEARCH/2.22.1 VSEARCH supports de novo and reference based chimera detection, clustering, full-length and prefix dereplication, rereplication, reverse complementation, masking, all-vs-all pairwise global alignment, exact and global alignment searching, shuffling, subsampling and sorting. It also supports FASTQ file analysis, filtering, conversion and merging of paired-end reads.
VTK VTK/9.0.1
VTK/9.1.0
VTK/9.2.2
VTK/9.2.6
VTK/9.3.0
The Visualization Toolkit (VTK) is an open-source, freely available software system for 3D computer graphics, image processing and visualization. VTK consists of a C++ class library and several interpreted interface layers including Tcl/Tk, Java, and Python. VTK supports a wide variety of visualization algorithms including: scalar, vector, tensor, texture, and volumetric methods; and advanced modeling techniques such as: implicit modeling, polygon reduction, mesh smoothing, cutting, contouring, and Delaunay triangulation.
VTUNE VTune/2022.3.0
VTune/2025.0.0
Intel VTune Amplifier XE is the premier performance profiler for C, C++, C#, Fortran, Assembly and Java.
VALGRIND Valgrind/3.21.0
Valgrind/3.23.0
Valgrind: Debugging and profiling tools
VELVET Velvet/1.2.10-mt-kmer_191 Sequence assembler for very short reads
VIRTUALGL VirtualGL/3.1 VirtualGL is an open source toolkit that gives any Linux or Unix remote display software the ability to run OpenGL applications with full hardware acceleration.
VORO++ Voro++/0.4.6 Voro++ is a software library for carrying out three-dimensional computations of the Voronoi tessellation. A distinguishing feature of the Voro++ library is that it carries out cell-based calculations, computing the Voronoi cell for each particle individually. It is particularly well-suited for applications that rely on cell-based statistics, where features of Voronoi cells (eg. volume, centroid, number of faces) can be used to analyze a system of particles.
VULKANSDK VulkanSDK/1.3.239.0
VulkanSDK/1.3.283.0
The Khronos Vulkan API is an explicit, low-overhead, cross-platform graphics and compute API.
WFA2 WFA2/2.3.4 The wavefront alignment (WFA) algorithm is an exact gap-affine algorithm that takes advantage of homologous regions between the sequences to accelerate the alignment process.
WPS WPS/4.4-dmpar WRF Preprocessing System (WPS) for WRF. The Weather Research and Forecasting (WRF) Model is a next-generation mesoscale numerical weather prediction system designed to serve both operational forecasting and atmospheric research needs.
WRF WRF/4.2.2-dmpar
WRF/4.4-dmpar
WRF/4.4.1-dmpar
WRF/4.5.1-dmpar
The Weather Research and Forecasting (WRF) Model is a next-generation mesoscale numerical weather prediction system designed to serve both operational forecasting and atmospheric research needs.
WAYLAND Wayland/1.20.0
Wayland/1.21.0
Wayland/1.22.0
Wayland/1.23.0
Wayland is a project to define a protocol for a compositor to talk to its clients as well as a library implementation of the protocol. The compositor can be a standalone display server running on Linux kernel modesetting and evdev input devices, an X application, or a wayland client itself. The clients can be traditional applications, X servers (rootless or fullscreen) or other display servers.
WAYLANDPP Waylandpp/1.0.0 Wayland is an object oriented display protocol, which features request and events. Requests can be seen as method calls on certain objects, whereas events can be seen as signals of an object. This makes the Wayland protocol a perfect candidate for a C++ binding. The goal of this library is to create such a C++ binding for Wayland using the most modern C++ technology currently available, providing an easy to use C++ API to Wayland.
WEBKITGTK+ WebKitGTK+/2.37.1 WebKitGTK+ is a full-featured port of the WebKit rendering engine, suitable for projects requiring any kind of web integration, from hybrid HTML/CSS applications to full-fledged web browsers. It offers WebKit's full functionality and is useful in a wide range of systems from desktop computers to embedded systems like phones, tablets, and televisions.
WEBPROXY WebProxy/0000 WebProxy module sets up web proxy environment variables, http_proxy and https_proxy, for internet acceess from the compute nodes. Wiki page: https://hprc.tamu.edu/wiki/SW:WebProxy
X11 X11/20201008
X11/20210518
X11/20210802
X11/20220504
X11/20221110
X11/20230603
X11/20231019
X11/20240607
The X Window System (X11) is a windowing system for bitmap displays
XGBOOST XGBoost/1.7.2 XGBoost is an optimized distributed gradient boosting library designed to be highly efficient, flexible and portable.
XML-LIBXML XML-LibXML/2.0207
XML-LibXML/2.0208
XML-LibXML/2.0209
Perl binding for libxml2
XZ XZ/5.2.5
XZ/5.2.7
XZ/5.4.2
XZ/5.4.4
XZ/5.4.5
xz: XZ utilities
XERCES-C++ Xerces-C++/3.2.4
Xerces-C++/3.2.5
Xerces-C++ is a validating XML parser written in a portable subset of C++. Xerces-C++ makes it easy to give your application the ability to read and write XML data. A shared library is provided for parsing, generating, manipulating, and validating XML documents using the DOM, SAX, and SAX2 APIs.
XLSXWRITER XlsxWriter/3.0.8 A Python module for creating Excel XLSX files
XVFB Xvfb/1.20.11
Xvfb/1.20.13
Xvfb/21.1.3
Xvfb/21.1.6
Xvfb/21.1.8
Xvfb/21.1.9
Xvfb is an X server that can run on machines with no display hardware and no physical input devices. It emulates a dumb framebuffer using virtual memory.
YACS YACS/0.1.8 YACS was created as a lightweight library to define and manage system configurations, such as those commonly found in software designed for scientific experimentation. These "configurations" typically cover concepts like hyperparameters used in training a machine learning model or configurable model hyperparameters, such as the depth of a convolutional neural network.
YASM Yasm/1.3.0 Yasm: Complete rewrite of the NASM assembler with BSD license
Z3 Z3/4.8.12
Z3/4.10.2-Python-3.10.4
Z3/4.10.2
Z3/4.12.2-Python-3.11.3
Z3/4.12.2
Z3/4.13.0
Z3 is a theorem prover from Microsoft Research.
ZEROMQ ZeroMQ/4.3.4
ZeroMQ/4.3.5
ZeroMQ looks like an embeddable networking library but acts like a concurrency framework. It gives you sockets that carry atomic messages across various transports like in-process, inter-process, TCP, and multicast. You can connect sockets N-to-N with patterns like fanout, pub-sub, task distribution, and request-reply. It's fast enough to be the fabric for clustered products. Its asynchronous I/O model gives you scalable multicore applications, built as asynchronous message-processing tasks. It has a score of language APIs and runs on most operating systems.
ZIP Zip/3.0 Zip is a compression and file packaging/archive utility. Although highly compatible both with PKWARE's PKZIP and PKUNZIP utilities for MS-DOS and with Info-ZIP's own UnZip, our primary objectives have been portability and other-than-MSDOS functionality
ZOLTAN Zoltan/3.901 Zoltan Dynamic Load Balancing and Graph Algorithm Toolkit
ABSL-PY absl-py/2.1.0 absl-py is a collection of Python library code for building Python applications. The code is collected from Google's own Python code base, and has been extensively tested and used in production.
ACCELERATE accelerate/0.33.0-CUDA-12.1.1 A simple way to launch, train, and use PyTorch models on almost any device and distributed configuration, automatic mixed precision (including fp8), and easy-to-configure FSDP and DeepSpeed support.
AIOHTTP aiohttp/3.8.3
aiohttp/3.8.5
aiohttp/3.9.5
Asynchronous HTTP client/server framework for asyncio and Python.
ALSA-LIB alsa-lib/1.2.8
alsa-lib/1.2.9
The Advanced Linux Sound Architecture (ALSA) provides audio and MIDI functionality to the Linux operating system.
ANADAMA2 anadama2/0.10.0 AnADAMA2 is the next generation of AnADAMA (Another Automated Data Analysis Management Application). AnADAMA is a tool to create reproducible workflows and execute them efficiently.
ANNOVAR annovar/20200607 ANNOVAR is an efficient software tool to utilize update-to-date information to functionally annotate genetic variants detected from diverse genomes (including human genome hg18, hg19, hg38, as well as mouse, worm, fly, yeast and many others).
ANT ant/1.10.11-Java-11
ant/1.10.12-Java-11
ant/1.10.14-Java-11
Apache Ant is a Java library and command-line tool whose mission is to drive processes described in build files as targets and extension points dependent upon each other. The main known usage of Ant is the build of Java applications.
ARCHSPEC archspec/0.1.2
archspec/0.1.3
archspec/0.1.4
archspec/0.2.0
archspec/0.2.1
A library for detecting, labeling, and reasoning about microarchitectures
ARGOBOTS argobots/1.2 Argobots is a lightweight, low-level threading and tasking framework.
ARIA2 aria2/1.35.0 aria2 is a lightweight multi-protocol & multi-source command-line download utility.
ARM-GNU-TOOLCHAIN arm-gnu-toolchain/12.3 Arm GNU Toolchain is a community supported pre-built GNU compiler toolchain for Arm based CPUs.
ARM-GNU-TOOLCHAINT arm-gnu-toolchainT/12.3 Arm GNU Toolchain is a community supported pre-built GNU compiler toolchain for Arm based CPUs.
ARPACK-NG arpack-ng/3.8.0
arpack-ng/3.9.0
arpack-ng/3.9.1
ARPACK is a collection of Fortran77 subroutines designed to solve large scale eigenvalue problems.
ARROW-R arrow-R/8.0.0-R-4.2.1
arrow-R/11.0.0.3-R-4.2.2
arrow-R/14.0.1-R-4.3.2
R interface to the Apache Arrow C++ library
ASSIMP assimp/5.2.5
assimp/5.3.1
Open Asset Import Library (assimp) is a library to import and export various 3d-model-formats including scene-post-processing to generate missing render data.
AT-SPI2-ATK at-spi2-atk/2.38.0 AT-SPI 2 toolkit bridge
AT-SPI2-CORE at-spi2-core/2.40.3
at-spi2-core/2.44.1
at-spi2-core/2.46.0
at-spi2-core/2.49.91
at-spi2-core/2.50.0
Assistive Technology Service Provider Interface.
ATTR attr/2.5.1 Commands for Manipulating Filesystem Extended Attributes
ATTRDICT3 attrdict3/2.0.2 AttrDict is a Python library that provides mapping objects that allow their elements to be accessed both as keys and as attributes.
AWSCLI awscli/2.11.21 Universal Command Line Environment for AWS
BAZELISK bazelisk/1.25.0 Bazelisk is a wrapper for Bazel written in Go.
BCRYPT bcrypt/4.0.1 Acceptable password hashing for your software and your servers (but you should really use argon2id or scrypt)
BENCHMARK benchmark/1.9.0 A microbenchmark support library.
BINUTILS binutils/2.31.1
binutils/2.32
binutils/2.35
binutils/2.36.1
binutils/2.37
binutils/2.38
binutils/2.39
binutils/2.40
binutils/2.42
binutils: GNU binary utilities
BIOM-FORMAT biom-format/2.1.12 The BIOM file format (canonically pronounced biome) is designed to be a general-use format for representing biological sample by observation contingency tables. BIOM is a recognized standard for the Earth Microbiome Project and is a Genomics Standards Consortium supported project.
BOKEH bokeh/2.4.1
bokeh/2.4.2
bokeh/2.4.3
bokeh/3.2.2
bokeh/3.4.1
Statistical and novel interactive HTML plots for Python
BOTO3 boto3/1.28.70 Boto3 is the Amazon Web Services (AWS) Software Development Kit (SDK) for Python, which allows Python developers to write software that makes use of services like Amazon S3 and Amazon EC2.
BTLLIB btllib/1.7.0 Bioinformatics Technology Lab common code library
BWIDGET bwidget/1.9.15 The BWidget Toolkit is a high-level Widget Set for Tcl/Tk built using native Tcl/Tk 8.x namespaces.
BZIP2 bzip2/1.0.8 bzip2 is a freely available, patent free, high-quality data compressor. It typically compresses files to within 10% to 15% of the best available techniques (the PPM family of statistical compressors), whilst being around twice as fast at compression and six times faster at decompression.
C-ARES c-ares/1.17.2
c-ares/1.18.1
c-ares is a C library for asynchronous DNS requests (including name resolves)
CURL cURL/7.72.0
cURL/7.76.0
cURL/7.78.0
cURL/7.83.0
cURL/7.86.0
cURL/8.0.1
cURL/8.3.0
cURL/8.7.1
libcurl is a free and easy-to-use client-side URL transfer library, supporting DICT, FILE, FTP, FTPS, Gopher, HTTP, HTTPS, IMAP, IMAPS, LDAP, LDAPS, POP3, POP3S, RTMP, RTSP, SCP, SFTP, SMTP, SMTPS, Telnet and TFTP. libcurl supports SSL certificates, HTTP POST, HTTP PUT, FTP uploading, HTTP form based upload, proxies, cookies, user+password authentication (Basic, Digest, NTLM, Negotiate, Kerberos), file transfer resume, http proxy tunneling and more.
CAIRO cairo/1.16.0
cairo/1.17.4
cairo/1.17.8
cairo/1.18.0
Cairo is a 2D graphics library with support for multiple output devices. Currently supported output targets include the X Window System (via both Xlib and XCB), Quartz, Win32, image buffers, PostScript, PDF, and SVG file output. Experimental backends include OpenGL, BeOS, OS/2, and DirectFB
CAPSTONE capstone/5.0.1 Capstone is a disassembly framework with the target of becoming the ultimate disasm engine for binary analysis and reversing in the security community.
CAPTUM captum/0.5.0 Captum is a model interpretability and understanding library for PyTorch. Captum means comprehension in Latin and contains general purpose implementations of integrated gradients, saliency maps, smoothgrad, vargrad and others for PyTorch models. It has quick integration for models built with domain-specific libraries such as torchvision, torchtext, and others.
CCACHE ccache/4.6.1
ccache/4.6.3
Ccache (or “ccache”) is a compiler cache. It speeds up recompilation by caching previous compilations and detecting when the same compilation is being done again
CDSAPI cdsapi/0.5.1 Climate Data Store API
CFFI cffi/1.15.1
cffi/1.16.0
C Foreign Function Interface for Python. Interact with almost any C code from Python, based on C-like declarations that you can often copy-paste from header files or documentation.
CHARLIECLOUD charliecloud/0.33 Charliecloud provides user-defined software stacks (UDSS) for high-performance computing (HPC) centers.
CHEMPROP chemprop/1.5.2-CUDA-11.7.0 Message Passing Neural Networks for Molecule Property Prediction
CIMFOMFA cimfomfa/22.273 This library supports both MCL, a cluster algorithm for graphs, and zoem, a macro/DSL language. It supplies abstractions for memory management, I/O, associative arrays, strings, heaps, and a few other things. The string library has had heavy testing as part of zoem. Both understandably and regrettably I chose long ago to make it C-string-compatible, hence nul bytes may not be part of a string. At some point I hope to rectify this, perhaps unrealistically.
CISTEM cisTEM/1.0.0-beta-Linux64 cisTEM is user-friendly software to process cryo-EM images of macromolecular complexes and obtain high-resolution 3D reconstructions from them.
CKDMIP ckdmip/1.0 Software for the Correlated K-Distribution Model Intercomparison Project (CKDMIP).
COLORIZE colorize/0.7.7 Ruby gem for colorizing text using ANSI escape sequences. Extends String class or add a ColorizedString with methods to set the text color, background color and text effects.
COLOSSALAI colossalai/0.1.8-CUDA-11.3.1
colossalai/0.3.0-CUDA-12.1.1
Colossal-AI: A Unified Deep Learning System for Big Model Era
CONFIGURABLE-HTTP-PROXY configurable-http-proxy/4.5.6 HTTP proxy for node.js including a REST API for updating the routing table. Developed as a part of the Jupyter Hub multi-user server.
CPIO cpio/2.15 The cpio package contains tools for archiving.
CPPY cppy/1.1.0
cppy/1.2.1
A small C++ header library which makes it easier to write Python extension modules. The primary feature is a PyObject smart pointer which automatically handles reference counting and provides convenience methods for performing common object operations.
CRB-BLAST crb-blast/0.6.9 Conditional Reciprocal Best BLAST - high confidence ortholog assignment.
CRYPTOGRAPHY cryptography/41.0.1
cryptography/41.0.4
cryptography/41.0.5
cryptography/42.0.8
cryptography is a package designed to expose cryptographic primitives and recipes to Python developers.
CUDF cuDF/23.04.0
cuDF/23.08.00
Built based on the Apache Arrow columnar memory format, cuDF is a GPU DataFrame library for loading, joining, aggregating, filtering, and otherwise manipulating data.
CUDNN cuDNN/8.0.4.30-CUDA-11.1.1
cuDNN/8.2.1.32-CUDA-11.3.1
cuDNN/8.2.2.26-CUDA-11.4.1
cuDNN/8.4.1.50-CUDA-11.7.0
cuDNN/8.5.0.96-CUDA-11.7.0
cuDNN/8.6.0.163-CUDA-11.8.0
cuDNN/8.7.0.84-CUDA-11.8.0
cuDNN/8.8.0.121-CUDA-12.0.0
cuDNN/8.9.2.26-CUDA-12.1.1
cuDNN/8.9.2.26-CUDA-12.2.0
cuDNN/8.9.7.29-CUDA-12.3.0
cuDNN/9.5.0.50-CUDA-12.6.0
The NVIDIA CUDA Deep Neural Network library (cuDNN) is a GPU-accelerated library of primitives for deep neural networks.
CUSPARSELT cuSPARSELt/0.5.0.1-CUDA-12.2.2
cuSPARSELt/0.6.0.6-CUDA-12.1.1
NVIDIA cuSPARSELt is a high-performance CUDA library dedicated to general matrix-matrix operations in which at least one operand is a sparse matrix
CUTENSOR cuTENSOR/1.6.1.5-CUDA-11.4.1
cuTENSOR/1.6.1.5-CUDA-11.7.0
cuTENSOR/1.7.0.1-CUDA-12.0.0
cuTENSOR/2.0.1.2-CUDA-12.1.1
cuTENSOR/2.0.2.5-CUDA-12.6.0
The cuTENSOR Library is a GPU-accelerated tensor linear algebra library providing tensor contraction, reduction and elementwise operations.
CUDA_PYTHON cuda_python/0.2.0 CUDA Python is the home for accessing NVIDIA’s CUDA platform from Python.
CUTADAPT cutadapt/3.5
cutadapt/4.2
Cutadapt finds and removes adapter sequences, primers, poly-A tails and other types of unwanted sequence from your high-throughput sequencing reads.
CYTHON-BLIS cython-blis/0.9.1 Fast BLAS-like operations from Python and Cython, without the tears. Provides the Blis linear algebra routines as a self-contained Python C-extension.
DREP dRep/3.4.2 dRep is a python program which performs rapid pair-wise comparison of genome sets. One of it’s major purposes is for genome de-replication, but it can do a lot more.
DACE dace/1.0.2 DaCe is a fast parallel programming framework that takes code in Python/NumPy and other programming languages, and maps it to high-performance CPU, GPU, and FPGA programs, which can be optimized to achieve state-of-the-art.
DASK dask/2021.9.1
dask/2022.1.0
dask/2022.10.0
dask/2023.9.2
dask/2024.5.1
Dask natively scales Python. Dask provides advanced parallelism for analytics, enabling performance at scale for the tools you love.
DASK-LABEXTENSION dask-labextension/7.0.0 This package provides a JupyterLab extension to manage Dask clusters, as well as embed Dask's dashboard plots directly into JupyterLab panes.
DBUS-GLIB dbus-glib/0.112 D-Bus is a message bus system, a simple way for applications to talk to one another.
DEEPDIFF deepdiff/5.7.0
deepdiff/5.8.1
deepdiff/6.7.1
DeepDiff: Deep Difference of dictionaries, iterables and almost any other object recursively.
DILL dill/0.3.4
dill/0.3.6
dill/0.3.7
dill extends python's pickle module for serializing and de-serializing python objects to the majority of the built-in python types. Serialization is the process of converting an object to a byte stream, and the inverse of which is converting a byte stream back to on python object hierarchy.
DM-TREE dm-tree/0.1.6
dm-tree/0.1.8
dm-tree provides tree, a library for working with nested data structures. In a way, tree generalizes the builtin map function which only supports flat sequences, and allows to apply a function to each "leaf" preserving the overall structure.
DOCKER-USER docker-user/202311 Rootless mode allows running the Docker daemon and containers as a non-root user to mitigate potential vulnerabilities in the daemon and the container runtime. Rootless mode executes the Docker daemon and containers inside a user namespace. To start the daemon: 'dockerd-rootless-setuptool.sh install --skip-iptables'. To test it: 'docker run hello-world'. To stop the daemon: 'dockerd-rootless-setuptool.sh uninstall --skip-iptables'
DOUBLE-CONVERSION double-conversion/3.1.5
double-conversion/3.2.0
double-conversion/3.2.1
double-conversion/3.3.0
Efficient binary-decimal and decimal-binary conversion routines for IEEE doubles.
ECBUILD ecBuild/3.7.0
ecBuild/3.8.0
A CMake-based build system, consisting of a collection of CMake macros and functions that ease the managing of software build systems
ECCODES ecCodes/2.24.2
ecCodes/2.27.0
ecCodes/2.31.0
ecCodes is a package developed by ECMWF which provides an application programming interface and a set of tools for decoding and encoding messages in the following formats: WMO FM-92 GRIB edition 1 and edition 2, WMO FM-94 BUFR edition 3 and edition 4, WMO GTS abbreviated header (only decoding).
EGGNOG-MAPPER eggnog-mapper/2.1.9 EggNOG-mapper is a tool for fast functional annotation of novel sequences. It uses precomputed orthologous groups and phylogenies from the eggNOG database (http://eggnog5.embl.de) to transfer functional information from fine-grained orthologs only. Common uses of eggNOG-mapper include the annotation of novel genomes, transcriptomes or even metagenomic gene catalogs.
EINOPS einops/0.4.1
einops/0.7.0
Flexible and powerful tensor operations for readable and reliable code. Supports numpy, pytorch, tensorflow, jax, and others.
ELFUTILS elfutils/0.187
elfutils/0.189
The elfutils project provides libraries and tools for ELF files and DWARF data.
ENCHANT-2 enchant-2/2.3.3 Enchant aims to provide a simple but comprehensive abstraction for dealing with different spell checking libraries in a consistent way. A client, such as a text editor or word processor, need not know anything about a specific spell-checker, and since all back-ends are plugins, new spell-checkers can be added without needing any change to the program using Enchant.
EXIV2 exiv2/0.27.5 Exiv2 is a Cross-platform C++ library and a command line utility to manage image metadata.
EXPAT expat/2.2.9
expat/2.4.1
expat/2.4.8
expat/2.4.9
expat/2.5.0
expat/2.6.2
Expat is an XML parser library written in C. It is a stream-oriented parser in which an application registers handlers for things the parser might find in the XML document (like start tags)
EXPECT expect/5.45.4 Expect is a tool for automating interactive applications such as telnet, ftp, passwd, fsck, rlogin, tip, etc. Expect really makes this stuff trivial. Expect is also useful for testing these same applications.
EXPECTTEST expecttest/0.1.3
expecttest/0.1.5
This library implements expect tests (also known as "golden" tests). Expect tests are a method of writing tests where instead of hard-coding the expected output of a test, you run the test to get the output, and the test framework automatically populates the expected output. If the output of the test changes, you can rerun the test with the environment variable EXPECTTEST_ACCEPT=1 to automatically update the expected output.
EZTRACE eztrace/2.1 EZTrace is a tool that aims at generating automatically execution trace from HPC programs.
FASTAHACK fastahack/1.0.0 Utilities for indexing and sequence extraction from FASTA files.
FASTAI fastai/2.7.10 The fastai deep learning library.
FERMI-LITE fermi-lite/20190320 Standalone C library for assembling Illumina short reads in small regions.
FETK fetk/1.5 FETK The Finite Element ToolKit (FETK) is a collaboratively developed, evolving collection of adaptive finite element method (AFEM) software libraries and tools for solving coupled systems of nonlinear geometric partial differential equations (PDE).
FFNVCODEC ffnvcodec/11.1.5.2
ffnvcodec/12.0.16.0
ffnvcodec/12.1.14.0
FFmpeg nvidia headers. Adds support for nvenc and nvdec. Requires Nvidia GPU and drivers to be present (picked up dynamically).
FILE file/5.43 The file command is 'a file type guesser', that is, a command-line tool that tells you in words what kind of data a file contains.
FILEVERCMP filevercmp/20191210 filevercmp function as in sort --version-sort.
FLATBUFFERS flatbuffers/1.12.0
flatbuffers/2.0.0
flatbuffers/2.0.7
flatbuffers/23.1.4
flatbuffers/23.5.26
FlatBuffers: Memory Efficient Serialization Library
FLATBUFFERS-PYTHON flatbuffers-python/1.12
flatbuffers-python/2.0
flatbuffers-python/23.1.4
flatbuffers-python/23.5.26
Python Flatbuffers runtime library.
FLEX flex/2.6.4 Flex (Fast Lexical Analyzer) is a tool for generating scanners. A scanner, sometimes called a tokenizer, is a program which recognizes lexical patterns in text.
FLIT flit/3.9.0 A simple packaging tool for simple packages.
FMT fmt/10.1.0
fmt/10.2.0
fmt (formerly cppformat) is an open-source formatting library.
FONTCONFIG fontconfig/2.13.92
fontconfig/2.13.93
fontconfig/2.13.94
fontconfig/2.14.0
fontconfig/2.14.1
fontconfig/2.14.2
fontconfig/2.15.0
Fontconfig is a library designed to provide system-wide font configuration, customization and application access.
FOSS foss/2020b
foss/2021a
foss/2021b
foss/2022a
foss/2022b
foss/2023a
foss/2023b
foss/2023.09
foss/2024a
foss/2024.05
GNU Compiler Collection (GCC) based compiler toolchain, including OpenMPI for MPI support, OpenBLAS (BLAS and LAPACK support), FFTW and ScaLAPACK.
FOSSCUDA fosscuda/2020b GCC based compiler toolchain __with CUDA support__, and including OpenMPI for MPI support, OpenBLAS (BLAS and LAPACK support), FFTW and ScaLAPACK.
FREEBAYES freebayes/1.3.7-R-4.3.2 Bayesian haplotype-based genetic polymorphism discovery and genotyping.
FREEGLUT freeglut/3.2.1
freeglut/3.2.2
freeglut/3.4.0
freeglut is a completely OpenSourced alternative to the OpenGL Utility Toolkit (GLUT) library.
FREETYPE freetype/2.10.3
freetype/2.10.4
freetype/2.11.0
freetype/2.12.1
freetype/2.13.0
freetype/2.13.2
FreeType 2 is a software font engine that is designed to be small, efficient, highly customizable, and portable while capable of producing high-quality output (glyph images). It can be used in graphics libraries, display servers, font conversion tools, text image generation tools, and many other products as well.
FSOM fsom/20151117 A tiny C library for managing SOM (Self-Organizing Maps) neural networks.
G2CLIB g2clib/1.6.3
g2clib/1.7.0
Library contains GRIB2 encoder/decoder ('C' version).
G2LIB g2lib/3.2.0 Library contains GRIB2 encoder/decoder and search/indexing routines.
GC gc/8.2.0
gc/8.2.4
The Boehm-Demers-Weiser conservative garbage collector can be used as a garbage collecting replacement for C malloc or C++ new.
GCCCUDA gcccuda/2020b GNU Compiler Collection (GCC) based compiler toolchain, along with CUDA toolkit.
GDOWN gdown/5.2.0 Google Drive Public File Downloader when curl/wget Fails
GENOMEPY genomepy/0.16.1 genomepy is designed to provide a simple and straightforward way to download and use genomic data
GEOCUBE geocube/0.4.3 Tool to convert geopandas vector data into rasterized xarray data.
GEOPANDAS geopandas/0.12.2
geopandas/0.14.2
GeoPandas is a project to add support for geographic data to pandas objects. It currently implements GeoSeries and GeoDataFrame types which are subclasses of pandas.Series and pandas.DataFrame respectively. GeoPandas objects can act on shapely geometry objects and perform geometric operations.
GETTEXT gettext/0.21
gettext/0.21.1
gettext/0.22
gettext/0.22.5
GNU 'gettext' is an important step for the GNU Translation Project, as it is an asset on which we may build many other steps. This package offers to programmers, translators, and even users, a well integrated set of tools and documentation
GFBF gfbf/2022a
gfbf/2022b
gfbf/2023a
gfbf/2023b
gfbf/2023.09
gfbf/2024a
gfbf/2024.05
GNU Compiler Collection (GCC) based compiler toolchain, including FlexiBLAS (BLAS and LAPACK support) and (serial) FFTW.
GIFLIB giflib/5.2.1 giflib is a library for reading and writing gif images. It is API and ABI compatible with libungif which was in wide use while the LZW compression algorithm was patented.
GIT git/2.28.0-nodocs
git/2.32.0-nodocs
git/2.33.1-nodocs
git/2.36.0-nodocs
git/2.38.1-nodocs
git/2.41.0-nodocs
git/2.42.0
git/2.45.1
Git is a free and open source distributed version control system designed to handle everything from small to very large projects with speed and efficiency.
GIT-LFS git-lfs/3.2.0
git-lfs/3.3.0
git-lfs/3.5.1
Git Large File Storage (LFS) replaces large files such as audio samples, videos, datasets, and graphics with text pointers inside Git, while storing the file contents on a remote server like GitHub.com
GLEW glew/2.2.0-egl
glew/2.2.0-osmesa
The OpenGL Extension Wrangler Library (GLEW) is a cross-platform open-source C/C++ extension loading library. GLEW provides efficient run-time mechanisms for determining which OpenGL extensions are supported on the target platform.
GLIB-NETWORKING glib-networking/2.72.1 Network extensions for GLib
GMPY2 gmpy2/2.1.2
gmpy2/2.1.5
GMP/MPIR, MPFR, and MPC interface to Python 2.6+ and 3.x
GNUPLOT gnuplot/5.4.4
gnuplot/5.4.6
gnuplot/5.4.8
Portable interactive, function plotting utility
GOMKL gomkl/2022a GNU Compiler Collection (GCC) based compiler toolchain with OpenMPI and MKL
GOMPI gompi/2020b
gompi/2021a
gompi/2021b
gompi/2022a
gompi/2022b
gompi/2023a
gompi/2023b
gompi/2023.05
gompi/2023.09
gompi/2024a
gompi/2024.05
GNU Compiler Collection (GCC) based compiler toolchain, including OpenMPI for MPI support.
GOMPIC gompic/2020b GNU Compiler Collection (GCC) based compiler toolchain along with CUDA toolkit, including OpenMPI for MPI support with CUDA features enabled.
GOOGLETEST googletest/1.11.0
googletest/1.12.1
googletest/1.13.0
googletest/1.14.0
Google's framework for writing C++ tests on a variety of platforms
GPERF gperf/3.1 GNU gperf is a perfect hash function generator. For a given list of strings, it produces a hash function and hash table, in form of C or C++ code, for looking up a value depending on the input string. The hash function is perfect, which means that the hash table has no collisions, and the hash table lookup needs a single string comparison only.
GPERFTOOLS gperftools/2.10
gperftools/2.12
gperftools/2.13
gperftools is a collection of a high-performance multi-threaded malloc() implementation, plus some pretty nifty performance analysis tools. Includes TCMalloc, heap-checker, heap-profiler and cpu-profiler.
GPFLOW GPflow/2.9.0-CUDA-11.7.0-TensorFlow-2.11.0
gpflow/2.9.0-CUDA-11.7.0-TensorFlow-2.11.0
gpflow/2.9.0-CUDA-11.7.0
GPflow is a package for building Gaussian process models in python, using TensorFlow.
GPGME gpgme/1.23.2 GnuPG Made Easy (GPGME) is a library designed to make access to GnuPG easier for applications. It provides a High-Level Crypto API for encryption, decryption, signing, signature verification and key management.
GPUSTAT gpustat/1.1 A simple command-line utility for querying and monitoring GPU status
GRAPHITE2 graphite2/1.3.14 Graphite is a "smart font" system developed specifically to handle the complexities of lesser-known languages of the world.
GRAPHVIZ-PYTHON graphviz-python/0.20.1 Simple Python interface for Graphviz
GREAT_TABLES great_tables/0.17.0 Make awesome display tables using Python.
GROFF groff/1.22.4
groff/1.23.0
Groff (GNU troff) is a typesetting system that reads plain text mixed with formatting commands and produces formatted output.
GRPCIO grpcio/1.57.0 gRPC is a modern, open source, high-performance remote procedure call (RPC) framework that can run anywhere. gRPC enables client and server applications to communicate transparently, and simplifies the building of connected systems.
GSLIB gslib/1.0.8 A sparse communication library.
GZIP gzip/1.10
gzip/1.12
gzip/1.13
gzip (GNU zip) is a popular data compression program as a replacement for compress
H5PY h5py/3.1.0
h5py/3.2.1
h5py/3.6.0
h5py/3.7.0
h5py/3.8.0
h5py/3.9.0
h5py/3.10.0
HDF5 for Python (h5py) is a general-purpose Python interface to the Hierarchical Data Format library, version 5. HDF5 is a versatile, mature scientific software library designed for the fast, flexible storage of enormous amounts of data.
HATCH-JUPYTER-BUILDER hatch-jupyter-builder/0.9.1 Hatch Jupyter Builder is a plugin for the hatchling Python build backend. It is primarily targeted for package authors who are providing JavaScript as part of their Python packages. Typical use cases are Jupyter Lab Extensions and Jupyter Widgets.
HATCHLING hatchling/1.16.1
hatchling/1.18.0
hatchling/1.24.2
Extensible, standards compliant build backend used by Hatch, a modern, extensible Python project manager.
HELP2MAN help2man/1.47.7
help2man/1.47.8
help2man/1.47.16
help2man/1.48.3
help2man/1.49.2
help2man/1.49.3
help2man produces simple manual pages from the '--help' and '--version' output of other commands.
HIREDIS hiredis/1.0.2 Hiredis is a minimalistic C client library for the Redis database. It is minimalistic because it just adds minimal support for the protocol, but at the same time it uses a high level printf-alike API in order to make it much higher level than otherwise suggested by its minimal code base and the lack of explicit bindings for every Redis command.
HUGGINGFACE_HUB huggingface_hub/0.27.1 The official Python client for the Huggingface Hub.
HUMANN HUMAnN/3.9
humann/3.6
HUMAnN v3 is a pipeline for efficiently and accurately determining the coverage and abundance of microbial pathways in a community from metagenomic data. Sequencing a metagenome typically produces millions of short DNA/RNA reads. This process, referred to as functional profiling, aims to describe the metabolic potential of a microbial community and its members. More generally, functional profiling answers the question: What are the microbes in my community-of-interest doing (or capable of doing)?
HUNSPELL hunspell/1.7.1 Hunspell is a spell checker and morphological analyzer library and program designed for languageswith rich morphology and complex word compounding or character encoding.
HWLOC hwloc/2.2.0
hwloc/2.4.1
hwloc/2.5.0
hwloc/2.7.1
hwloc/2.8.0
hwloc/2.9.1
hwloc/2.9.2
hwloc/2.10.0
The Portable Hardware Locality (hwloc) software package provides a portable abstraction (across OS, versions, architectures, ...) of the hierarchical topology of modern architectures, including NUMA memory nodes, sockets, shared caches, cores and simultaneous multithreading. It also gathers various system attributes such as cache and memory information as well as the locality of I/O devices such as network interfaces, InfiniBand HCAs or GPUs. It primarily aims at helping applications with gathering information about modern computing hardware so as to exploit it accordingly and efficiently.
HYPOTHESIS hypothesis/5.41.2
hypothesis/6.13.1
hypothesis/6.14.6
hypothesis/6.46.7
hypothesis/6.68.2
hypothesis/6.82.0
hypothesis/6.88.1
hypothesis/6.90.0
hypothesis/6.103.1
Hypothesis is an advanced testing library for Python. It lets you write tests which are parametrized by a source of examples, and then generates simple and comprehensible examples that make your tests fail. This lets you find more bugs in your code with less work.
IIMPI iimpi/2021b
iimpi/2022a
iimpi/2022b
iimpi/2022.12
iimpi/2023a
iimpi/2023b
iimpi/2023.03
iimpi/2023.07
iimpi/2024a
Intel C/C++ and Fortran compilers, alongside Intel MPI.
IMAGEIO imageio/2.22.2
imageio/2.33.1
Imageio is a Python library that provides an easy interface to read and write a wide range of image data, including animated images, video, volumetric data, and scientific formats.
IMAKE imake/1.0.8 imake is a Makefile-generator that is intended to make it easier to develop software portably for multiple systems.
IMBALANCED-LEARN imbalanced-learn/0.10.1 imbalanced-learn is a Python package offering a number of re-sampling techniques commonly used in datasets showing strong between-class imbalance.
IMKL imkl/2021.4.0
imkl/2022.1.0
imkl/2022.2.1
imkl/2023.0.0
imkl/2023.1.0
imkl/2023.2.0
imkl/2024.0.0
imkl/2024.2.0
Intel oneAPI Math Kernel Library
IMKL-FFTW imkl-FFTW/2021.4.0
imkl-FFTW/2022.1.0
imkl-FFTW/2022.2.1
imkl-FFTW/2023.0.0
imkl-FFTW/2023.1.0
imkl-FFTW/2023.2.0
imkl-FFTW/2024.2.0
FFTW interfaces using Intel oneAPI Math Kernel Library
IMPI impi/2021.4.0
impi/2021.6.0
impi/2021.7.1
impi/2021.8.0
impi/2021.9.0
impi/2021.10.0
impi/2021.11.0
impi/2021.13.0
Intel MPI Library, compatible with MPICH ABI
INTEL intel/2021b
intel/2022a
intel/2022b
intel/2022.11
intel/2022.12
intel/2023a
intel/2023b
intel/2023.03
intel/2023.07
intel/2024a
Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL).
INTEL-COMPILERS intel-compilers/2021.2.0
intel-compilers/2021.4.0
intel-compilers/2022.1.0
intel-compilers/2022.2.0
intel-compilers/2022.2.1
intel-compilers/2023.0.0
intel-compilers/2023.1.0
intel-compilers/2023.2.1
intel-compilers/2024.0.0
intel-compilers/2024.2.0
intel-compilers/2025.0.0
Intel C, C++ & Fortran compilers (classic and oneAPI)
INTEL/AIKIT intel/AIKit
intel/AIKit
intel/AIKit
Intel AI Analytic Toolkit installed using Miniconda3
INTELPYTHON intelpython/2024.1.0_814 This is the Intel Python distribution.
INTERVALTREE intervaltree/0.1 An interval tree can be used to efficiently find a set of numeric intervals overlapping or containing another interval. This library provides a basic implementation of an interval tree using C++ templates, allowing the insertion of arbitrary types into the tree.
INTLTOOL intltool/0.51.0 intltool is a set of tools to centralize translation of many different file formats using GNU gettext-compatible PO files.
JAX jax/0.2.20
jax/0.3.25-CUDA-11.7.0
jax/0.3.25
jax/0.4.4-CUDA-11.8.0
jax/0.4.4
Composable transformations of Python+NumPy programs: differentiate, vectorize, JIT to GPU/TPU, and more
JBIGKIT jbigkit/2.1 JBIG-KIT is a software implementation of the JBIG1 data compression standard (ITU-T T.82), which was designed for bi-level image data, such as scanned documents.
JEDI jedi/0.19.1 Jedi - an awesome autocompletion, static analysis and refactoring library for Python.
JEMALLOC jemalloc/5.2.1
jemalloc/5.3.0
jemalloc is a general purpose malloc(3) implementation that emphasizes fragmentation avoidance and scalable concurrency support.
JSON-C json-c/0.16
json-c/0.17
JSON-C implements a reference counting object model that allows you to easily construct JSON objects in C, output them as JSON formatted strings and parse JSON formatted strings back into the C representation of JSON objects.
JUPYTER-RESOURCE-USAGE jupyter-resource-usage/1.0.0 Jupyter Notebook Extension for monitoring your own Resource Usage (memory and/or CPU)
JUPYTER-SERVER jupyter-server/1.21.0
jupyter-server/2.7.0
jupyter-server/2.7.2
jupyter-server/2.14.0
The Jupyter Server provides the backend (i.e. the core services, APIs, and REST endpoints) for Jupyter web applications like Jupyter notebook, JupyterLab, and Voila.
JUPYTER-SERVER-PROXY jupyter-server-proxy/4.0.0
jupyter-server-proxy/4.1.2
Jupyter Server Proxy lets you run arbitrary external processes (such as RStudio, Shiny Server, Syncthing, PostgreSQL, Code Server, etc) alongside your notebook server and provide authenticated web access to them using a path like /rstudio next to others like /lab. Alongside the python package that provides the main functionality, the JupyterLab extension (@jupyterlab/server-proxy) provides buttons in the JupyterLab launcher window to get to RStudio for example.
JUPYTERLMOD jupyterlmod/4.0.3
jupyterlmod/5.2.1
Jupyter interactive notebook server extension that allows users to interact with environment modules before launching kernels. The extension uses Lmod's Python interface to accomplish module-related tasks like loading, unloading, saving collections, etc.
KALLISTO kallisto/0.48.0 kallisto is a program for quantifying abundances of transcripts from RNA-Seq data, or more generally of target sequences using high-throughput sequencing reads.
KBLAS-GPU kblas-gpu/20231024-CUDA-11.8.0 KAUST BLAS (KBLAS) is a high performance CUDA library implementing a subset of BLAS as well as Linear Algebra PACKage (LAPACK) routines on NVIDIA GPUs.
KIM-API kim-api/2.2.1
kim-api/2.3.0
Open Knowledgebase of Interatomic Models. KIM is an API and OpenKIM is a collection of interatomic models (potentials) for atomistic simulations. This is a library that can be used by simulation programs to get access to the models in the OpenKIM database. This EasyBuild only installs the API, the models can be installed with the package openkim-models, or the user can install them manually by running kim-api-collections-management install user MODELNAME or kim-api-collections-management install user OpenKIM to install them all.
KINETO kineto/0.4.0 A CPU+GPU Profiling library that provides access to timeline traces and hardware performance counters
LIBGLU libGLU/9.0.1
libGLU/9.0.2
libGLU/9.0.3
The OpenGL Utility Library (GLU) is a computer graphics library for OpenGL.
LIBROM libROM/93ca278 A free, lightweight, scalable C++ library for data-driven physical simulation methods from the intrusive projection-based reduced order models to non-intrusive black-box approaches.
LIBAEC libaec/1.0.6 Libaec provides fast lossless compression of 1 up to 32 bit wide signed or unsigned integers (samples). The library achieves best results for low entropy data as often encountered in space imaging instrument data or numerical model output from weather or climate simulations. While floating point representations are not directly supported, they can also be efficiently coded by grouping exponents and mantissa.
LIBAIO libaio/0.3.112 Asynchronous input/output library that uses the kernels native interface.
LIBARCHIVE libarchive/3.4.3
libarchive/3.5.1
libarchive/3.6.1
libarchive/3.6.2
libarchive/3.7.2
libarchive/3.7.4
Multi-format archive and compression library
LIBASSUAN libassuan/2.5.7 Libassuan is a small library implementing the so-called Assuan protocol. This protocol is used for IPC between most newer GnuPG components. Both, server and client side functions are provided.
LIBATOMIC_OPS libatomic_ops/7.8.2 This package provides semi-portable access to hardware-provided atomic memory update operations on a number of architectures.
LIBCERF libcerf/2.1
libcerf/2.3
libcerf is a self-contained numeric library that provides an efficient and accurate implementation of complex error functions, along with Dawson, Faddeeva, and Voigt functions.
LIBDAP libdap/3.20.7 A C++ SDK which contains an implementation of DAP 2.0 and DAP4.0. This includes both Client- and Server-side support classes.
LIBDEFLATE libdeflate/1.10
libdeflate/1.15
libdeflate/1.18
libdeflate/1.19
libdeflate/1.20
Heavily optimized library for DEFLATE/zlib/gzip compression and decompression.
LIBDIVSUFSORT libdivsufsort/2.0.1 libdivsufsort is a software library that implements a lightweight suffix array construction algorithm.
LIBDRM libdrm/2.4.106
libdrm/2.4.107
libdrm/2.4.110
libdrm/2.4.114
libdrm/2.4.115
libdrm/2.4.117
libdrm/2.4.122
Direct Rendering Manager runtime library.
LIBEPOXY libepoxy/1.5.8
libepoxy/1.5.10
Epoxy is a library for handling OpenGL function pointer management for you
LIBEV libev/4.33 A full-featured and high-performance (see benchmark) event loop that is loosely modelled after libevent, but without its limitations and bugs. It is used in GNU Virtual Private Ethernet, rxvt-unicode, auditd, the Deliantra MORPG Server and Client, and many other programs.
LIBEVENT libevent/2.1.12 The libevent API provides a mechanism to execute a callback function when a specific event occurs on a file descriptor or after a timeout has been reached. Furthermore, libevent also support callbacks due to signals or regular timeouts.
LIBFABRIC libfabric/1.11.0
libfabric/1.12.1
libfabric/1.13.2
libfabric/1.15.1
libfabric/1.16.1
libfabric/1.18.0
libfabric/1.19.0
libfabric/1.21.0
Libfabric is a core component of OFI. It is the library that defines and exports the user-space API of OFI, and is typically the only software that applications deal with directly. It works in conjunction with provider libraries, which are often integrated directly into libfabric.
LIBFFI libffi/3.3
libffi/3.4.2
libffi/3.4.4
libffi/3.4.5
The libffi library provides a portable, high level programming interface to various calling conventions. This allows a programmer to call any function specified by a call interface description at run-time.
LIBFYAML libfyaml/0.9 Fully feature complete YAML parser and emitter, supporting the latest YAML spec and passing the full YAML testsuite.
LIBGCRYPT libgcrypt/1.9.3 Libgcrypt is a general purpose cryptographic library originally based on code from GnuPG
LIBGD libgd/2.3.3 GD is an open source code library for the dynamic creation of images by programmers.
LIBGEOTIFF libgeotiff/1.6.0
libgeotiff/1.7.0
libgeotiff/1.7.1
libgeotiff/1.7.3
Library for reading and writing coordinate system information from/to GeoTIFF files
LIBGIT2 libgit2/1.1.0
libgit2/1.1.1
libgit2/1.4.3
libgit2/1.5.0
libgit2/1.7.1
libgit2/1.7.2
libgit2/1.8.1
libgit2 is a portable, pure C implementation of the Git core methods provided as a re-entrant linkable library with a solid API, allowing you to write native speed custom Git applications in any language which supports C bindings.
LIBGLVND libglvnd/1.3.3
libglvnd/1.4.0
libglvnd/1.6.0
libglvnd/1.7.0
libglvnd is a vendor-neutral dispatch layer for arbitrating OpenGL API calls between multiple vendors.
LIBGPG-ERROR libgpg-error/1.42
libgpg-error/1.49
Libgpg-error is a small library that defines common error values for all GnuPG components.
LIBGPUARRAY libgpuarray/0.7.6 Library to manipulate tensors on the GPU.
LIBICONV libiconv/1.16
libiconv/1.17
Libiconv converts from one character encoding to another through Unicode conversion
LIBIDN libidn/1.38 GNU Libidn is a fully documented implementation of the Stringprep, Punycode and IDNA specifications. Libidn's purpose is to encode and decode internationalized domain names.
LIBIDN2 libidn2/2.3.2
libidn2/2.3.7
Libidn2 implements the revised algorithm for internationalized domain names called IDNA2008/TR46.
LIBJPEG-TURBO libjpeg-turbo/2.0.5
libjpeg-turbo/2.0.6
libjpeg-turbo/2.1.3
libjpeg-turbo/2.1.4
libjpeg-turbo/2.1.5.1
libjpeg-turbo/3.0.1
libjpeg-turbo is a fork of the original IJG libjpeg which uses SIMD to accelerate baseline JPEG compression and decompression. libjpeg is a library that implements JPEG image encoding, decoding and transcoding.
LIBMAD libmad/0.15.1b MAD is a high-quality MPEG audio decoder.
LIBNSL libnsl/2.0.0 The libnsl package contains the public client interface for NIS(YP).
LIBOGG libogg/1.3.4
libogg/1.3.5
Ogg is a multimedia container format, and the native file and stream format for the Xiph.org multimedia codecs.
LIBOPUS libopus/1.3.1
libopus/1.4
libopus/1.5.2
Opus is a totally open, royalty-free, highly versatile audio codec. Opus is unmatched for interactive speech and music transmission over the Internet, but is also intended for storage and streaming applications. It is standardized by the Internet Engineering Task Force (IETF) as RFC 6716 which incorporated technology from Skype’s SILK codec and Xiph.Org’s CELT codec.
LIBPCIACCESS libpciaccess/0.16
libpciaccess/0.17
libpciaccess/0.18.1
Generic PCI access library.
LIBPNG libpng/1.6.37
libpng/1.6.38
libpng/1.6.39
libpng/1.6.40
libpng/1.6.43
libpng is the official PNG reference library
LIBPRESSIO libpressio/20250303-11a1edf LibPressio is a C++ library with C compatible bindings to abstract between different lossless and lossy compressors and their configurations.
LIBPSL libpsl/0.21.1 C library for the Public Suffix List
LIBREADLINE libreadline/8.0
libreadline/8.1
libreadline/8.1.2
libreadline/8.2
The GNU Readline library provides a set of functions for use by applications that allow users to edit command lines as they are typed in. Both Emacs and vi editing modes are available. The Readline library includes additional functions to maintain a list of previously-entered command lines, to recall and perhaps reedit those lines, and perform csh-like history expansion on previous commands.
LIBROSA librosa/0.10.1 Audio and music processing in Python
LIBRSVG librsvg/2.55.1 Librsvg is a library to render SVG files using cairo.
LIBRTTOPO librttopo/1.1.0 The RT Topology Library exposes an API to create and manage standard (ISO 13249 aka SQL/MM) topologies using user-provided data stores.
LIBSECCOMP libseccomp/2.5.5 The libseccomp library provides an easy to use, platform independent, interface to the Linux Kernel's syscall filtering mechanism. The libseccomp API is designed to abstract away the underlying BPF based syscall filter language and present a more conventional function-call based filtering interface that should be familiar to, and easily adopted by, application developers.
LIBSHARP2 libsharp2/20240830 Library for efficient spherical harmonic transforms at arbitrary spins, supporting CPU vectorization, OpenMP and MPI.
LIBSNDFILE libsndfile/1.0.31
libsndfile/1.1.0
libsndfile/1.2.0
libsndfile/1.2.2
Libsndfile is a C library for reading and writing files containing sampled sound (such as MS Windows WAV and the Apple/SGI AIFF format) through one standard library interface.
LIBSODIUM libsodium/1.0.18
libsodium/1.0.19
Sodium is a modern, easy-to-use software library for encryption, decryption, signatures, password hashing and more.
LIBSPATIALINDEX libspatialindex/1.9.3 C++ implementation of R*-tree, an MVR-tree and a TPR-tree with C API
LIBSPATIALITE libspatialite/5.0.1 SpatiaLite is an open source library intended to extend the SQLite core to support fully fledged Spatial SQL capabilities.
LIBTASN1 libtasn1/4.18.0
libtasn1/4.19.0
Libtasn1 is the ASN.1 library used by GnuTLS, GNU Shishi and some other packages. It was written by Fabio Fiorina, and has been shipped as part of GnuTLS for some time but is now a proper GNU package.
LIBTIRPC libtirpc/1.3.1
libtirpc/1.3.2
libtirpc/1.3.3
libtirpc/1.3.4
Libtirpc is a port of Suns Transport-Independent RPC library to Linux.
LIBTOOL libtool/2.4.6
libtool/2.4.7
GNU libtool is a generic library support script. Libtool hides the complexity of using shared libraries behind a consistent, portable interface.
LIBUNISTRING libunistring/1.0
libunistring/1.1
This library provides functions for manipulating Unicode strings and for manipulating C strings according to the Unicode standard.
LIBUNWIND libunwind/1.4.0
libunwind/1.5.0
libunwind/1.6.2
libunwind/1.8.1
The primary goal of libunwind is to define a portable and efficient C programming interface (API) to determine the call-chain of a program. The API additionally provides the means to manipulate the preserved (callee-saved) state of each call-frame and to resume execution at any point in the call-chain (non-local goto). The API supports both local (same-process) and remote (across-process) operation. As such, the API is useful in a number of applications
LIBVDWXC libvdwxc/0.4.0 libvdwxc is a general library for evaluating energy and potential for exchange-correlation (XC) functionals from the vdW-DF family that can be used with various of density functional theory (DFT) codes.
LIBVORBIS libvorbis/1.3.7 Ogg Vorbis is a fully open, non-proprietary, patent-and-royalty-free, general-purpose compressed audio format
LIBVORI libvori/220621 C++ library implementing the Voronoi integration as well as the compressed bqb file format. The present version of libvori is a very early development version, which is hard-coded to work with the CP2k program package.
LIBWEBP libwebp/1.2.0
libwebp/1.2.4
libwebp/1.3.1
libwebp/1.3.2
WebP is a modern image format that provides superior lossless and lossy compression for images on the web. Using WebP, webmasters and web developers can create smaller, richer images that make the web faster.
LIBWPE libwpe/1.13.3 WPE is the reference WebKit port for embedded and low-consumption computer devices. It has been designed from the ground-up with performance, small footprint, accelerated content rendering, and simplicity of deployment in mind, bringing the excellence of the WebKit engine to countless platforms and target devices.
LIBXC libxc/5.2.3
libxc/6.1.0
libxc/6.2.2
Libxc is a library of exchange-correlation functionals for density-functional theory. The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals.
LIBXML2 libxml2/2.9.10
libxml2/2.9.13
libxml2/2.10.3
libxml2/2.11.4
libxml2/2.11.5
libxml2/2.12.7
Libxml2 is the XML C parser and toolchain developed for the Gnome project (but usable outside of the Gnome platform).
LIBXSLT libxslt/1.1.34
libxslt/1.1.37
libxslt/1.1.38
Libxslt is the XSLT C library developed for the GNOME project (but usable outside of the Gnome platform).
LIBXSMM libxsmm/1.17 LIBXSMM is a library for small dense and small sparse matrix-matrix multiplications targeting Intel Architecture (x86).
LIBYAML libyaml/0.2.5 LibYAML is a YAML parser and emitter written in C.
LIBZIP libzip/1.7.3 libzip is a C library for reading, creating, and modifying zip archives.
LIFELINES lifelines/0.27.4 lifelines is a complete survival analysis library, written in pure Python.
LIT lit/18.1.7 lit is a portable tool for executing LLVM and Clang style test suites, summarizing their results, and providing indication of failures.
LMOD lmod/ Lmod: An Environment Module System
LPSOLVE lpsolve/5.5.2.11 Mixed Integer Linear Programming (MILP) solver
LXML lxml/4.6.3
lxml/4.9.1
lxml/4.9.2
lxml/4.9.3
The lxml XML toolkit is a Pythonic binding for the C libraries libxml2 and libxslt.
LZ4 lz4/1.9.2
lz4/1.9.3
lz4/1.9.4
LZ4 is lossless compression algorithm, providing compression speed at 400 MB/s per core. It features an extremely fast decoder, with speed in multiple GB/s per core.
MAEPARSER maeparser/1.3.0
maeparser/1.3.1
maeparser is a parser for Schrodinger Maestro files.
MAGMA magma/2.6.1-CUDA-11.3.1
magma/2.6.2-CUDA-11.7.0
magma/2.6.2-CUDA-11.8.0
magma/2.7.1-CUDA-12.0.0
magma/2.7.2-CUDA-12.1.1
magma/2.7.2-CUDA-12.2.0
The MAGMA project aims to develop a dense linear algebra library similar to LAPACK but for heterogeneous/hybrid architectures, starting with current Multicore+GPU systems.
MAKE make/4.3
make/4.4.1
GNU version of make utility
MAKEDEPEND makedepend/1.0.6
makedepend/1.0.7
makedepend/1.0.9
The makedepend package contains a C-preprocessor like utility to determine build-time dependencies.
MAKEINFO makeinfo/6.7-minimal
makeinfo/7.0.3
makeinfo/7.1
makeinfo is part of the Texinfo project, the official documentation format of the GNU project. This is a minimal build with very basic functionality. Should only be used for build dependencies.
MARGO margo/0.19.0 Margo provides Argobots-aware bindings to the Mercury RPC library.
MATPLOTLIB matplotlib/3.3.3
matplotlib/3.4.2
matplotlib/3.4.3
matplotlib/3.5.2
matplotlib/3.7.0
matplotlib/3.7.2
matplotlib/3.8.2
matplotlib is a python 2D plotting library which produces publication quality figures in a variety of hardcopy formats and interactive environments across platforms. matplotlib can be used in python scripts, the python and ipython shell, web application servers, and six graphical user interface toolkits.
MATURIN maturin/1.1.0
maturin/1.3.1
maturin/1.4.0-Rust-1.75.0
maturin/1.5.0-Rust-1.76.0
maturin/1.6.0
This project is meant as a zero configuration replacement for setuptools-rust and milksnake. It supports building wheels for python 3.5+ on windows, linux, mac and freebsd, can upload them to pypi and has basic pypy and graalpy support.
MERCURY Mercury/2.4.0
mercury/2.4.0
Mercury is an RPC framework specifically designed for use in HPC systems that allows asynchronous transfer of parameters and execution requests, as well as direct support of large data arguments.
MESON-PYTHON meson-python/0.13.2
meson-python/0.15.0
meson-python/0.16.0
Python build backend (PEP 517) for Meson projects
MICROMAMBA micromamba/2.1.0-0 A statically-linked single file version of Mamba.
MINIMAP2 minimap2/2.26 Minimap2 is a fast sequence mapping and alignment program that can find overlaps between long noisy reads, or map long reads or their assemblies to a reference genome optionally with detailed alignment (i.e. CIGAR). At present, it works efficiently with query sequences from a few kilobases to ~100 megabases in length at an error rate ~15%. Minimap2 outputs in the PAF or the SAM format. On limited test data sets, minimap2 is over 20 times faster than most other long-read aligners. It will replace BWA-MEM for long reads and contig alignment.
MINIZIP minizip/1.1 Mini zip and unzip based on zlib
ML-COLLECTIONS ml-collections/0.1.1 ML Collections is a library of Python Collections designed for ML use cases.
ML_DTYPES ml_dtypes/0.3.2 ml_dtypes is a stand-alone implementation of several NumPy dtype extensions used in machine learning libraries, including: bfloat16: an alternative to the standard float16 format float8_*: several experimental 8-bit floating point representations including: float8_e4m3b11fnuz float8_e4m3fn float8_e4m3fnuz float8_e5m2 float8_e5m2fnuz
MODULAR modular/0.8.0 The Modular command-line interface.
MOLD mold/1.3.0
mold/1.11.0
mold/2.4.0
mold is a high-performance drop-in replacement for existing Unix linkers.
MOTIF motif/2.3.8 Motif refers to both a graphical user interface (GUI) specification and the widget toolkit for building applications that follow that specification under the X Window System on Unix and other POSIX-compliant systems. It was the standard toolkit for the Common Desktop Environment and thus for Unix.
MPI4PY mpi4py/3.1.4
mpi4py/3.1.5
mpi4py/4.0.1
MPI for Python (mpi4py) provides bindings of the Message Passing Interface (MPI) standard for the Python programming language, allowing any Python program to exploit multiple processors.
MRCFILE mrcfile/1.5.0 mrcfile is a Python implementation of the MRC2014 file format, which is used in structural biology to store image and volume data. It allows MRC files to be created and opened easily using a very simple API, which exposes the file’s header and data as numpy arrays. The code runs in Python 2 and 3 and is fully unit-tested. This library aims to allow users and developers to read and write standard- compliant MRC files in Python as easily as possible, and with no dependencies on any compiled libraries except numpy. You can use it interactively to inspect files, correct headers and so on, or in scripts and larger software packages to provide basic MRC file I/O functions.
MULTICHOOSE multichoose/1.0.3 generate multiset combinations (n multichoose k).
MUSL musl/1.2.4 An implementation of the C standard library built on top of the Linux system call API, including interfaces defined in the base language standard, POSIX, and widely agreed-upon extensions.
MYGENE mygene/3.2.2 Python Client for MyGene.Info services.
NANO nano/8.1 a simple editor, inspired by Pico
NANOGET nanoget/1.19.3 Functions to extract information from Oxford Nanopore sequencing data and alignments
NANOMATH nanomath/1.3.0 A few simple math functions for other Oxford Nanopore processing scripts
NBCLASSIC nbclassic/1.0.0 NbClassic provides a backwards compatible Jupyter Notebook interface that you can install side-by-side with the latest versions: That way, you can fearlessly upgrade without worrying about your classic extensions and customizations breaking.
NCBI-VDB ncbi-vdb/3.0.2
ncbi-vdb/3.0.5
The SRA Toolkit and SDK from NCBI is a collection of tools and libraries for using data in the INSDC Sequence Read Archives.
NCURSES ncurses/6.1
ncurses/6.2
ncurses/6.3
ncurses/6.4
ncurses/6.5
The Ncurses (new curses) library is a free software emulation of curses in System V Release 4.0, and more. It uses Terminfo format, supports pads and color and multiple highlights and forms characters and function-key mapping, and has all the other SYSV-curses enhancements over BSD Curses.
NETCDF netCDF/4.7.4
netCDF/4.8.0
netCDF/4.8.1
netCDF/4.9.0
netCDF/4.9.2
NetCDF (network Common Data Form) is a set of software libraries and machine-independent data formats that support the creation, access, and sharing of array-oriented scientific data.
NETCDF-C++4 netCDF-C++4/4.3.1 NetCDF (network Common Data Form) is a set of software libraries and machine-independent data formats that support the creation, access, and sharing of array-oriented scientific data.
NETCDF-FORTRAN netCDF-Fortran/4.5.3
netCDF-Fortran/4.6.0
netCDF-Fortran/4.6.1
NetCDF (network Common Data Form) is a set of software libraries and machine-independent data formats that support the creation, access, and sharing of array-oriented scientific data.
NETCDF4-PYTHON netcdf4-python/1.6.1
netcdf4-python/1.6.4
Python/numpy interface to netCDF.
NETTLE nettle/3.7.2
nettle/3.7.3
nettle/3.8
nettle/3.8.1
nettle/3.9.1
Nettle is a cryptographic library that is designed to fit easily in more or less any context: In crypto toolkits for object-oriented languages (C++, Python, Pike, ...), in applications like LSH or GNUPG, or even in kernel space.
NETWORKX networkx/2.6.3
networkx/2.8.4
networkx/3.0
networkx/3.1
networkx/3.2.1
NetworkX is a Python package for the creation, manipulation, and study of the structure, dynamics, and functions of complex networks.
NGHTTP2 nghttp2/1.48.0 This is an implementation of the Hypertext Transfer Protocol version 2 in C. The framing layer of HTTP/2 is implemented as a reusable C library. On top of that, we have implemented an HTTP/2 client, server and proxy. We have also developed load test and benchmarking tools for HTTP/2. An HPACK encoder and decoder are available as a public API.
NGHTTP3 nghttp3/0.6.0 nghttp3 is an implementation of RFC 9114 HTTP/3 mapping over QUIC and RFC 9204 QPACK in C. It does not depend on any particular QUIC transport implementation.
NGTCP2 ngtcp2/0.7.0 'Call it TCP/2. One More Time.' ngtcp2 project is an effort to implement RFC9000 QUIC protocol.
NLOHMANN_JSON nlohmann_json/3.10.5
nlohmann_json/3.11.2
nlohmann_json/3.11.3
JSON for Modern C++
NMAD nmad/20220531 PM2 is an umbrella software suite for high-performance runtime systems. Modules may be installed and used together or separately.
NODEJS nodejs/14.17.0
nodejs/14.17.6
nodejs/16.15.1
nodejs/18.12.1
nodejs/18.17.1
nodejs/20.9.0
Node.js is a platform built on Chrome's JavaScript runtime for easily building fast, scalable network applications. Node.js uses an event-driven, non-blocking I/O model that makes it lightweight and efficient, perfect for data-intensive real-time applications that run across distributed devices.
NSYNC nsync/1.24.0
nsync/1.25.0
nsync/1.26.0
nsync is a C library that exports various synchronization primitives, such as mutexes
NUMACTL numactl/2.0.13
numactl/2.0.14
numactl/2.0.16
numactl/2.0.18
The numactl program allows you to run your application program on specific cpu's and memory nodes. It does this by supplying a NUMA memory policy to the operating system before running your program. The libnuma library provides convenient ways for you to add NUMA memory policies into your own program.
NUMBA numba/0.52.0
numba/0.53.1
numba/0.54.1-CUDA-11.4.1
numba/0.56.4-CUDA-11.7.0
numba/0.56.4
numba/0.58.1
Numba is an Open Source NumPy-aware optimizing compiler for Python sponsored by Continuum Analytics, Inc. It uses the remarkable LLVM compiler infrastructure to compile Python syntax to machine code.
NUMPY numpy/1.26.4 NumPy is the fundamental package for scientific computing with Python.
NVIDIA-CONTAINER-CLI nvidia-container-cli/1.13.2-1-hprc NVIDIA container command line tools provides a list of locally installed libraries that Charliecloud needs to interface to the local NVIDIA GPUs.
NVTOP nvtop/3.0.1
nvtop/3.0.2
htop-like GPU usage monitor
OPENPYXL openpyxl/3.1.2 A Python library to read/write Excel 2010 xlsx/xlsm files
OTF2 OTF2/3.0.3
otf2/3.0.3
The OTF2 library provides an interface to write and read trace data.
P11-KIT p11-kit/0.24.1
p11-kit/0.25.3
Provides a way to load and enumerate PKCS#11 modules. Provides a standard configuration setup for installing PKCS#11 modules in such a way that they're discoverable. Also solves problems with coordinating the use of PKCS#11 by different components or libraries living in the same process.
P7ZIP p7zip/17.04 p7zip is a quick port of 7z.exe and 7za.exe (CLI version of 7zip) for Unix. 7-Zip is a file archiver with highest compression ratio.
PARALLEL parallel/20210722
parallel/20230722
parallel: Build and execute shell commands in parallel
PARAMETERIZED parameterized/0.9.0 Parameterized testing with any Python test framework
PATCHELF patchelf/0.15.0
patchelf/0.17.2
patchelf/0.18.0
PatchELF is a small utility to modify the dynamic linker and RPATH of ELF executables.
PBLAT pblat/2.5.1 When the query file format is fasta, you can specify many threads to process it. It can reduce run time linearly, and use almost equal memory as the original blat program. This is useful when you blat a big query file to a huge reference like human whole genome sequence.
PETSC4PY petsc4py/3.20.3 petsc4py are Python bindings for PETSc, the Portable, Extensible Toolchain for Scientific Computation.
PHYSICS-TENPY physics-tenpy/0.10.0 TeNPy (short for ‘Tensor Network Python’) is a Python library for the simulation of strongly correlated quantum systems with tensor networks.
PICARD picard/2.25.1-Java-11 A set of tools (in Java) for working with next generation sequencing data in the BAM format.
PIGZ pigz/2.6
pigz/2.7
pigz, which stands for parallel implementation of gzip, is a fully functional replacement for gzip that exploits multiple processors and multiple cores to the hilt when compressing data. pigz was written by Mark Adler, and uses the zlib and pthread libraries.
PIOMAN pioman/20220531 PM2 is an umbrella software suite for high-performance runtime systems. Modules may be installed and used together or separately.
PIPENV pipenv/2025.0.2 Pipenv is a Python virtualenv management tool that supports a multitude of systems and nicely bridges the gaps between pip, python (using system python, pyenv or asdf) and virtualenv. Pipenv automatically creates and manages a virtualenv for your projects, as well as adds/removes packages from your Pipfile as you install/uninstall packages.
PIXMAN pixman/0.40.0
pixman/0.42.2
Pixman is a low-level software library for pixel manipulation, providing features such as image compositing and trapezoid rasterization. Important users of pixman are the cairo graphics library and the X server.
PKG-CONFIG pkg-config/0.29.2 pkg-config is a helper tool used when compiling applications and libraries. It helps you insert the correct compiler options on the command line so an application can use gcc -o test test.c `pkg-config --libs --cflags glib-2.0` for instance, rather than hard-coding values on where to find glib (or other libraries).
PKGCONF pkgconf/1.8.0
pkgconf/1.9.3
pkgconf/1.9.5
pkgconf/2.0.3
pkgconf/2.2.0
pkgconf is a program which helps to configure compiler and linker flags for development libraries. It is similar to pkg-config from freedesktop.org.
PKGCONFIG pkgconfig/1.5.1-python
pkgconfig/1.5.4-python
pkgconfig/1.5.5-python
pkgconfig is a Python module to interface with the pkg-config command line tool
PLOTLY.PY plotly.py/5.12.0
plotly.py/5.13.1
plotly.py/5.18.0
plotly.py/5.23.0
An open-source, interactive graphing library for Python
POCL pocl/1.8
pocl/4.0-CUDA-12.1.1
pocl/4.0
Pocl is a portable open source (MIT-licensed) implementation of the OpenCL standard
PODMAN podman/5.1.0-rc1 Podman is an open source container, pod, and container image management engine. Podman makes it easy to find, run, build, and share containers.
POETRY poetry/1.5.1
poetry/1.6.1
poetry/1.7.1
poetry/1.8.3
Python packaging and dependency management made easy. Poetry helps you declare, manage and install dependencies of Python projects, ensuring you have the right stack everywhere.
POLARS polars/0.20.2
polars/0.47.1
Polars is a blazingly fast DataFrame library for manipulating structured data. The core is written in Rust and this module provides its interface for Python.
POPPLER poppler/22.12.0
poppler/23.09.0
Poppler is a PDF rendering library
PPLACER pplacer/1.1.alpha19 Pplacer places query sequences on a fixed reference phylogenetic tree to maximize phylogenetic likelihood or posterior probability according to a reference alignment. Pplacer is designed to be fast, to give useful information about uncertainty, and to offer advanced visualization and downstream analysis.
PRODIGAL prodigal/2.6.3 Prodigal (Prokaryotic Dynamic Programming Genefinding Algorithm) is a microbial (bacterial and archaeal) gene finding program developed at Oak Ridge National Laboratory and the University of Tennessee.
PROKKA prokka/1.14.5 Prokka is a software tool for the rapid annotation of prokaryotic genomes.
PROTOBUF protobuf/3.14.0
protobuf/3.17.3
protobuf/3.19.4
protobuf/23.0
protobuf/24.0
protobuf/25.3
Google Protocol Buffers
PROTOBUF-PYTHON protobuf-python/3.14.0
protobuf-python/3.17.3
protobuf-python/3.19.4
protobuf-python/4.23.0
protobuf-python/4.24.0
Python Protocol Buffers runtime library.
PSUTIL psutil/5.9.8 A cross-platform process and system utilities module for Python
PSYCOPG2 psycopg2/2.9.5
psycopg2/2.9.9
Psycopg is the most popular PostgreSQL adapter for the Python programming language.
PUGIXML pugixml/1.12.1 pugixml is a light-weight C++ XML processing library
PY-CPUINFO py-cpuinfo/9.0.0 py-cpuinfo gets CPU info with pure Python.
PY3DMOL py3Dmol/2.0.1.post1
py3Dmol/2.1.0
A simple IPython/Jupyter widget to embed an interactive 3Dmol.js viewer in a notebook.
PYBIND11 pybind11/2.6.0
pybind11/2.6.2
pybind11/2.7.1
pybind11/2.9.2
pybind11/2.10.3
pybind11/2.11.1
pybind11/2.12.0
pybind11/2.13.6
pybind11 is a lightweight header-only library that exposes C++ types in Python and vice versa, mainly to create Python bindings of existing C++ code.
PYDANTIC pydantic/1.10.4
pydantic/2.5.3
pydantic/2.7.4
Data validation and settings management using Python type hinting.
PYDICOM pydicom/2.3.0 Pure python package for DICOM medical file reading and writing.
PYFAIDX pyfaidx/0.8.1.1 pyfaidx: efficient pythonic random access to fasta subsequences
PYGAME pygame/2.5.2 Pygame is a set of Python modules designed for writing video games. Pygame adds functionality on top of the excellent SDL library. This allows you to create fully featured games and multimedia programs in the python language.
PYPROJ pyproj/3.5.0
pyproj/3.6.0
Python interface to PROJ4 library for cartographic transformations
PYTESSERACT pytesseract/0.3.10 Python-tesseract is an optical character recognition (OCR) tool for python. That is, it will recognize and "read" the text embedded in images. Python-tesseract is a wrapper for Google's Tesseract-OCR Engine. It is also useful as a stand-alone invocation script to tesseract, as it can read all image types supported by the Pillow and Leptonica imaging libraries, including jpeg, png, gif, bmp, tiff, and others. Additionally, if used as a script, Python-tesseract will print the recognized text instead of writing it to a file.
PYTEST pytest/7.2.2
pytest/7.4.2
The pytest framework makes it easy to write small, readable tests, and can scale to support complex functional testing for applications and libraries.
PYTEST-FLAKEFINDER pytest-flakefinder/1.1.0 Runs tests multiple times to expose flakiness.
PYTEST-RERUNFAILURES pytest-rerunfailures/11.1
pytest-rerunfailures/12.0
pytest plugin to re-run tests to eliminate flaky failures.
PYTEST-SHARD pytest-shard/0.1.2 pytest plugin to support parallelism across multiple machines. Shards tests based on a hash of their test name enabling easy parallelism across machines, suitable for a wide variety of continuous integration services. Tests are split at the finest level of granularity, individual test cases, enabling parallelism even if all of your tests are in a single file (or even single parameterized test method).
PYTEST-XDIST pytest-xdist/2.3.0
pytest-xdist/2.5.0
pytest-xdist/3.3.1
xdist: pytest distributed testing plugin The pytest-xdist plugin extends pytest with some unique test execution modes: * test run parallelization: if you have multiple CPUs or hosts you can use those for a combined test run. This allows to speed up development or to use special resources of remote machines. * --looponfail: run your tests repeatedly in a subprocess. After each run pytest waits until a file in your project changes and then re-runs the previously failing tests. This is repeated until all tests pass after which again a full run is performed. * Multi-Platform coverage: you can specify different Python interpreters or different platforms and run tests in parallel on all of them. Before running tests remotely, pytest efficiently “rsyncs” your program source code to the remote place. All test results are reported back and displayed to your local terminal. You may specify different Python versions and interpreters.
PYTHON-ISAL python-isal/0.11.1
python-isal/1.1.0
Faster zlib and gzip compatible compression and decompression by providing python bindings for the isa-l library.
RASTERIO rasterio/1.3.9 Rasterio reads and writes geospatial raster data.
RE2 RE2/2022-06-01
RE2/2023-03-01
RE2/2023-08-01
RE2/2024-03-01
RE2/2024-07-02
re2/2023-11-01
RE2 is a fast, safe, thread-friendly alternative to backtracking regular expression engines like those used in PCRE, Perl, and Python. It is a C++ library.
RE2C re2c/2.2
re2c/3.0
re2c/3.1
re2c is a free and open-source lexer generator for C and C++. Its main goal is generating fast lexers: at least as fast as their reasonably optimized hand-coded counterparts. Instead of using traditional table-driven approach, re2c encodes the generated finite state automata directly in the form of conditional jumps and comparisons.
REDIS-PY redis-py/4.5.1 The Python interface to the Redis key-value store.
RIOXARRAY rioxarray/0.15.0 Geospatial xarray extension powered by rasterio
RISING rising/0.2.2 Provides everything needed for high performance data loading and augmentation in PyTorch.
RNAQUAST rnaQUAST/2.2.2 rnaQUAST is a tool for evaluating RNA-Seq assemblies using reference genome and gene database. In addition, rnaQUAST is also capable of estimating gene database coverage by raw reads and de novo quality assessment using third-party software.
RPMREBUILD rpmrebuild/2.11 rpmrebuild is a tool to build an RPM file from a package that has already been installed in a basic use
RUAMEL.YAML ruamel.yaml/0.17.21
ruamel.yaml/0.17.32
ruamel.yaml is a YAML 1.2 loader/dumper package for Python.
SCIKIT-BIO scikit-bio/0.5.7 scikit-bio is an open-source, BSD-licensed Python 3 package providing data structures, algorithms and educational resources for bioinformatics.
SCIKIT-BUILD scikit-build/0.11.1
scikit-build/0.15.0
scikit-build/0.17.2
scikit-build/0.17.6
Scikit-Build, or skbuild, is an improved build system generator for CPython C/C++/Fortran/Cython extensions.
SCIKIT-BUILD-CORE scikit-build-core/0.9.3 Scikit-build-core is a complete ground-up rewrite of scikit-build on top of modern packaging APIs. It provides a bridge between CMake and the Python build system, allowing you to make Python modules with CMake.
SCIKIT-CUDA scikit-cuda/0.5.3-CUDA-11.8.0 SciKit-cuda, a.k.a. skcuda, provides Python interfaces to many of the functions in the CUDA device/runtime, CUBLAS, CUFFT, and CUSOLVER libraries distributed as part of NVIDIA's CUDA Programming Toolkit.
SCIKIT-IMAGE scikit-image/0.19.3
scikit-image/0.22.0
scikit-image is a collection of algorithms for image processing.
SCIKIT-LEARN scikit-learn/0.24.2
scikit-learn/1.1.2
scikit-learn/1.2.1
scikit-learn/1.3.1
scikit-learn/1.4.0
Scikit-learn integrates machine learning algorithms in the tightly-knit scientific Python world, building upon numpy, scipy, and matplotlib. As a machine-learning module, it provides versatile tools for data mining and analysis in any field of science and engineering. It strives to be simple and efficient, accessible to everybody, and reusable in various contexts.
SDSL-LITE sdsl-lite/2.1.1 The Succinct Data Structure Library (SDSL) is a powerful and flexible C++11 library implementing succinct data structures. In total, the library contains the highlights of 40 research publications. Succinct data structures can represent an object (such as a bitvector or a tree) in space close to the information-theoretic lower bound of the object while supporting operations of the original object efficiently. The theoretical time complexity of an operation performed on the classical data structure and the equivalent succinct data structure are (most of the time) identical.
SETTARG settarg/ The settarg module provides a way to connect the loaded modules with your build system by setting environment variables.
SETUPTOOLS setuptools/64.0.3 Easily download, build, install, upgrade, and uninstall Python packages
SETUPTOOLS-RUST setuptools-rust/1.6.0
setuptools-rust/1.7.0
setuptools-rust/1.8.0
setuptools-rust/1.9.0
setuptools-rust is a plugin for setuptools to build Rust Python extensions implemented with PyO3 or rust-cpython.
SMITHWATERMAN smithwaterman/20160702 smith-waterman-gotoh alignment algorithm.
SNAPPY snappy/1.1.8
snappy/1.1.9
snappy/1.1.10
snappy/1.2.1
Snappy is a compression/decompression library. It does not aim for maximum compression, or compatibility with any other compression library; instead, it aims for very high speeds and reasonable compression.
SPACY spaCy/3.4.4 Industrial-strength Natural Language Processing (NLP) in Python.
SPARSEHASH sparsehash/2.0.4 An extremely memory-efficient hash_map implementation. 2 bits/entry overhead! The SparseHash library contains several hash-map implementations, including implementations that optimize for space or speed.
SPGLIB spglib/2.0.2 Spglib is a C library for finding and handling crystal symmetries.
SPGLIB-PYTHON spglib-python/1.16.0
spglib-python/2.0.0
Spglib for Python. Spglib is a library for finding and handling crystal symmetries written in C.
SPYTHON spython/0.3.0 Singularity Python is a Python API to work with the Singularity open source software.
SQUASHENV squashenv/0
squashenv/0.1
SST-CORE sst-core/14.0.0 The Structural Simulation Toolkit (SST) was developed to explore innovations in highly concurrent systems where the ISA, microarchitecture, and memory interact with the programming model and communications system.
STATSMODELS statsmodels/0.13.1
statsmodels/0.14.1
Statsmodels is a Python module that allows users to explore data, estimate statistical models, and perform statistical tests.
STRACE strace/6.6 strace is a diagnostic, debugging and instructional userspace utility for Linux. It is used to monitor and tamper with interactions between processes and the Linux kernel, which include system calls, signal deliveries, and changes of process state.
SYMPY sympy/1.9
sympy/1.10.1
sympy/1.12
SymPy is a Python library for symbolic mathematics. It aims to become a full-featured computer algebra system (CAS) while keeping the code as simple as possible in order to be comprehensible and easily extensible. SymPy is written entirely in Python and does not require any external libraries.
SYNTHCITY synthcity/0.2.4 A library for generating and evaluating synthetic tabular data.
TABIXPP tabixpp/1.1.2 C++ wrapper to tabix indexer
TALLOC talloc/2.4.3 A hierarchical, reference counted memory pool system with destructors.
TBB tbb/2021.5.0
tbb/2021.11.0
Intel(R) Threading Building Blocks (Intel(R) TBB) lets you easily write parallel C++ programs that take full advantage of multicore performance, that are portable, composable and have future-proof scalability.
TBL2ASN tbl2asn/20230713-linux64 Tbl2asn is a command-line program that automates the creation of sequence records for submission to GenBank
TCSH tcsh/6.22.03
tcsh/6.24.01
tcsh/6.24.07
tcsh/6.24.10
Tcsh is an enhanced, but completely compatible version of the Berkeley UNIX C shell (csh). It is a command language interpreter usable both as an interactive login shell and a shell script command processor. It includes a command-line editor, programmable word completion, spelling correction, a history mechanism, job control and a C-like syntax.
TENSORBOARD tensorboard/2.8.0
tensorboard/2.10.0
tensorboard/2.15.1
TensorBoard is a suite of web applications for inspecting and understanding your TensorFlow runs and graphs.
TENSORBOARDX tensorboardX/2.5.1
tensorboardX/2.6.2.2
Tensorboard for PyTorch.
TENSORFLOW-PROBABILITY tensorflow-probability/0.19.0-CUDA-11.7.0 TensorFlow Probability (TFP) is a library for probabilistic reasoning and statistical analysis.
TENSORSTORE tensorstore/0.1.65 TensorStore is an open-source C++ and Python software library designed for storage and manipulation of large multi-dimensional arrays.
TESSERACT tesseract/5.3.0
tesseract/5.3.4
Tesseract is an optical character recognition engine
TEXLIVE texlive/20230313 TeX is a typesetting language. Instead of visually formatting your text, you enter your manuscript text intertwined with TeX commands in a plain text file. You then run TeX to produce formatted output, such as a PDF file. Thus, in contrast to standard word processors, your document is a separate file that does not pretend to be a representation of the final typeset output, and so can be easily edited and manipulated.
TIME time/1.9 The `time' command runs another program, then displays information about the resources used by that program, collected by the system while the program was running.
TMUX tmux/3.3a tmux is a terminal multiplexer: it enables a number of terminals to be created, accessed, and controlled from a single screen. tmux may be detached from a screen and continue running in the background, then later reattached.
TOKENIZERS tokenizers/0.15.2 Fast State-of-the-Art Tokenizers optimized for Research and Production
TORCHSAMPLER torchsampler/0.1.2 A (PyTorch) imbalanced dataset sampler for oversampling low classes and undersampling high frequent ones.
TORCHTEXT torchtext/0.14.1-PyTorch-1.12.0 Data loaders and abstractions for text and NLP
TORCHVISION torchvision/0.11.1-CUDA-11.3.1
torchvision/0.13.1-CUDA-11.7.0
torchvision/0.13.1
torchvision/0.16.0-CUDA-12.1.1
Datasets, Transforms and Models specific to Computer Vision
TORNADO tornado/6.3.2
tornado/6.4
Tornado is a Python web framework and asynchronous networking library.
TQDM tqdm/4.61.2
tqdm/4.64.0
tqdm/4.64.1
tqdm/4.66.1
tqdm/4.66.2
tqdm/4.67.1
A fast, extensible progress bar for Python and CLI
TURM turm/0.7.3 A text-based user interface (TUI) for the Slurm Workload Manager, which provides a convenient way to manage your cluster jobs.
TYPING-EXTENSIONS typing-extensions/3.7.4.3
typing-extensions/3.10.0.0
typing-extensions/3.10.0.2
typing-extensions/4.3.0
typing-extensions/4.9.0
typing-extensions/4.10.0
Typing Extensions – Backported and Experimental Type Hints for Python
UMAP-LEARN umap-learn/0.5.3 Uniform Manifold Approximation and Projection (UMAP) is a dimension reduction technique that can be used for visualisation similarly to t-SNE, but also for general non-linear dimension reduction.
UMOCI umoci/0.5.0 A reference implementation of the OCI image specification and provides users with the ability to create, manipulate, and otherwise interact with container images.
UTF8PROC utf8proc/2.7.0
utf8proc/2.8.0
utf8proc/2.9.0
utf8proc is a small, clean C library that provides Unicode normalization, case-folding, and other operations for data in the UTF-8 encoding.
UTIL-LINUX util-linux/2.36
util-linux/2.37
util-linux/2.38
util-linux/2.38.1
util-linux/2.39
util-linux/2.40
Set of Linux utilities
VASP vasp/6.3.2 The Vienna Ab initio Simulation Package (VASP) is a computer program for atomic scale materials modelling, e.g. electronic structure calculations and quantum-mechanical molecular dynamics, from first principles. VASP 6.3.2 - gpu compile - Homepage: http://www.vasp.at
VCFLIB vcflib/1.0.9-R-4.3.2 vcflib provides methods to manipulate and interpret sequence variation as it can be described by VCF. The Variant Call Format (VCF) is a flat-file, tab-delimited textual format intended to concisely describe reference-indexed genetic variations between individuals.
VIRTUALENV virtualenv/20.23.1
virtualenv/20.24.6
virtualenv/20.26.2
A tool for creating isolated virtual python environments.
WANDB wandb/0.13.4
wandb/0.13.6
wandb/0.16.1
CLI and Python API for Weights and Biases: a tool for visualizing and tracking your machine learning experiments.
WGET wget/1.21.3 GNU Wget is a free software package for retrieving files using HTTP, HTTPS and FTP, the most widely-used Internet protocols. It is a non-interactive commandline tool, so it may easily be called from scripts, cron jobs, terminals without X-Windows support, etc.
WPEBACKEND-FDO wpebackend-fdo/1.13.1 WPE WebKit allows embedders to create simple and performant systems based on Web platform technologies. It is a WebKit port designed with flexibility and hardware acceleration in mind, leveraging common 3D graphics APIs for best performance.
WXPYTHON wxPython/4.2.0 Wraps the wxWidgets C++ toolkit and provides access to the user interface portions of the wxWidgets API, enabling Python applications to have a native GUI on Windows, Macs or Unix systems, with a native look and feel and requiring very little (if any) platform specific code.
WXWIDGETS wxWidgets/3.2.0
wxWidgets/3.2.2.1
wxWidgets is a C++ library that lets developers create applications for Windows, Mac OS X, Linux and other platforms with a single code base. It has popular language bindings for Python, Perl, Ruby and many other languages, and unlike other cross-platform toolkits, wxWidgets gives applications a truly native look and feel because it uses the platform's native API rather than emulating the GUI.
X264 x264/20210414
x264/20210613
x264/20220620
x264/20230226
x264/20231019
x264 is a free software library and application for encoding video streams into the H.264/MPEG-4 AVC compression format, and is released under the terms of the GNU GPL.
X265 x265/3.5 x265 is a free software library and application for encoding video streams into the H.265 AVC compression format, and is released under the terms of the GNU GPL.
XARRAY xarray/0.20.1
xarray/2022.6.0
xarray/2022.9.0
xarray/2023.4.2
xarray/2023.9.0
xarray (formerly xray) is an open source project and Python package that aims to bring the labeled data power of pandas to the physical sciences, by providing N-dimensional variants of the core pandas data structures.
XMLTODICT xmltodict/0.13.0 Python module that makes working with XML feel like you are working with JSON.
XORG-MACROS xorg-macros/1.19.2
xorg-macros/1.19.3
xorg-macros/1.20.0
xorg-macros/1.20.1
X.org macros utilities.
XPMEM xpmem/61c39ef XPMEM is a Linux kernel module that enables a process to map the memory of another process into its virtual address space.
XPROP xprop/1.2.5
xprop/1.2.6
The xprop utility is for displaying window and font properties in an X server. One window or font is selected using the command line arguments or possibly in the case of a window, by clicking on the desired window. A list of properties is then given, possibly with formatting information.
XPROTO xproto/7.0.31 X protocol and ancillary headers
XXD xxd/8.2.4220
xxd/9.0.1696
xxd/9.0.2112
xxd/9.1.0307
xxd is part of the VIM package and this will only install xxd, not vim! xxd converts to/from hexdumps of binary files.
YAXT yaxt/0.11.2 A library built on top of MPI for redistributing data between two sets of processes.
YELL yell/2.2.2 Yell - Your Extensible Logging Library is a comprehensive logging replacement for Ruby.
ZARR zarr/2.13.3
zarr/2.16.0
Zarr is a Python package providing an implementation of compressed, chunked, N-dimensional arrays, designed for use in parallel computing.
ZFP zfp/1.0.0
zfp/20250218-bb76298
zfp is a compressed format for representing multidimensional floating-point and integer arrays. zfp provides compressed-array classes that support high throughput read and write random access to individual array elements. zfp also supports serial and parallel (OpenMP and CUDA) compression of whole arrays, e.g., for applications that read and write large data sets to and from disk.
ZLIB zlib/1.2.11
zlib/1.2.12
zlib/1.2.13
zlib/1.3.1
zlib is designed to be a free, general-purpose, legally unencumbered -- that is, not covered by any patents -- lossless data-compression library for use on virtually any computer hardware and operating system.
ZSTD zstd/1.4.5
zstd/1.4.9
zstd/1.5.0
zstd/1.5.2
zstd/1.5.5
zstd/1.5.6
Zstandard is a real-time compression algorithm, providing high compression ratios. It offers a very wide range of compression/speed trade-off, while being backed by a very fast decoder. It also offers a special mode for small data, called dictionary compression, and can create dictionaries from any sample set.