Modules specific to Niagara
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| Module | Versions | Documentation | Description |
|---|---|---|---|
| anaconda2 | 5.1.0 | Description: 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. Homepage: https://www.continuum.io/anaconda-overview | |
| anaconda3 | 2018.12 5.1.0 5.2.0 | Description: 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. Homepage: https://www.continuum.io/anaconda-overview | |
| antlr | 2.7.7 | Description: 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. Homepage: http://www.antlr2.org/ | |
| ants | 2.3.1 | Description: ANTs extracts information from complex datasets that include imaging. ANTs is useful for managing, interpreting and visualizing multidimensional data. Homepage: http://stnava.github.io/ANTs/ | |
| armadillo | 8.500.1 | Description: 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. Homepage: http://arma.sourceforge.net/ | |
| arpack-ng | 3.5.0 | Description: ARPACK is a collection of Fortran77 subroutines designed to solve large scale eigenvalue problems. Homepage: http://forge.scilab.org/index.php/p/arpack-ng/ | |
| aspect | 2.0.0 2.0.1 2.1.0-pre | Description: An extensible code written in C++ to support research in simulating convection in the Earth mantle and elsewhere. Homepage: https://aspect.geodynamics.org/ | |
| aspera-client | 3.8.1 | Description: Homepage: | |
| autotools | 2017 | Description: This bundle collect the standard GNU build tools: Autoconf, Automake and libtool Homepage: http://autotools.io | |
| bayestraits | 3.0.1 | Description: BayesTraits is a computer package for performing analyses of trait evolution among groups of species for which a phylogeny or sample of phylogenies is available. This new package incoporates our earlier and separate programes Multistate, Discrete and Continuous. BayesTraits can be applied to the analysis of traits that adopt a finite number of discrete states, or to the analysis of continuously varying traits. Hypotheses can be tested about models of evolution, about ancestral states and about correlations among pairs of traits. Homepage: http://www.evolution.reading.ac.uk/BayesTraitsV1.html | |
| bazel | 0.11.1 0.15.0 | Description: Bazel is a build tool that builds code quickly and reliably. It is used to build the majority of Google's software. Homepage: http://bazel.io/ | |
| bedops | 2.4.35 | Description: BEDOPS is an open-source command-line toolkit that performs highly efficient and scalable Boolean and other set operations, statistical calculations, archiving, conversion and other management of genomic data of arbitrary scale. Tasks can be easily split by chromosome for distributing whole-genome analyses across a computational cluster. Homepage: http://%(namelower)s.readthedocs.io/en/latest/index.html | |
| bedtools | 2.27.1 | Description: 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. Homepage: https://github.com/arq5x/bedtools2 | |
| blast+ | 2.7.1 | Description: 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. Homepage: http://blast.ncbi.nlm.nih.gov/ | |
| boost | 1.63.0 1.66.0 1.67.0 | Description: Boost provides free peer-reviewed portable C++ source libraries. Homepage: http://www.boost.org/ | |
| boost-mpi | 1.67.0 | Description: Boost provides free peer-reviewed portable C++ source libraries. Homepage: http://www.boost.org/ | |
| bwa | 0.7.17 | Description: Burrows-Wheeler Aligner (BWA) is an efficient program that aligns relatively short nucleotide sequences against a long reference sequence such as the human genome. Homepage: http://bio-bwa.sourceforge.net/ | |
| cdo | 1.9.4 | Description: CDO is a collection of command line Operators to manipulate and analyse Climate and NWP model Data. Homepage: https://code.zmaw.de/projects/cdo | |
| cereal | 1.2.2 | ||
| cfitsio | 3.430 | Description: CFITSIO is a library of C and Fortran subroutines for reading and writing data files in FITS (Flexible Image Transport System) data format. Homepage: http://heasarc.gsfc.nasa.gov/fitsio/ | |
| chaiscript | 6.1.0 | ||
| cmake | 3.10.3 3.11.0 3.11.1 | Description: CMake, the cross-platform, open-source build system. CMake is a family of tools designed to build, test and package software. Homepage: http://www.cmake.org | |
| cp2k | 6.1 | Description: 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. Homepage: http://www.cp2k.org/ | |
| dakota-mpi | 6.7.0 | Description: The Dakota project delivers both state-of-the-art research and robust, usable software for optimization and UQ. Broadly, the Dakota software's advanced parametric analyses enable design exploration, model calibration, risk analysis, and quantification of margins and uncertainty with computational models. The Dakota toolkit provides a flexible, extensible interface between such simulation codes and its iterative systems analysis methods, which include: - optimization with gradient and nongradient-based methods; - uncertainty quantification with sampling, reliability, stochastic expansion, and epistemic methods; - parameter estimation using nonlinear least squares (deterministic) or Bayesian inference (stochastic); and - sensitivity/variance analysis with design of experiments and parameter study methods. These capabilities may be used on their own or as components within advanced strategies such as hybrid optimization, surrogate-based optimization, mixed integer nonlinear programming, or optimization under uncertainty. Homepage: https://dakota.sandia.gov/ | |
| ddt | 18.1.2 18.2 | Description: ARM's HPC development tools: Distributed Debugging Tool and MAP Profiler Homepage: https://www.arm.com/products/development-tools/hpc-tools/cross-platform/forge | |
| diamond | 0.9.23 | Description: Accelerated BLAST compatible local sequence aligner Homepage: https://github.com/bbuchfink/diamond | |
| eigen | 3.3.4 | Description: Eigen is a C++ template library for linear algebra: matrices, vectors, numerical solvers, and related algorithms. Homepage: http://eigen.tuxfamily.org/index.php?title=Main_Page | |
| elpa | 2016.05.003 2017.05.003 2018.05.001 | ||
| esmf | 7.1.0r | Description: The Earth System Modeling Framework (ESMF) is software for building and coupling weather, climate, and related models. Homepage: http://sourceforge.net/projects/esmf | |
| fastme | 2.1.6.1 | Description: FastME: a comprehensive, accurate and fast distance-based phylogeny inference program. Homepage: http://www.atgc-montpellier.fr/fastme/ | |
| fenics | 2017.2.0 2018.1.0 | Description: Computing platform for solving partial differential equations. Homepage: https://fenicsproject.org | |
| fetk | 1.5 | ||
| ffmpeg | 3.4.2 | Description: A complete, cross-platform solution to record, convert and stream audio and video. Homepage: https://www.ffmpeg.org/ | |
| fftw | 3.3.7 | Description: 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. Homepage: http://www.fftw.org | |
| fftw-mpi | 3.3.7 | Description: 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. Homepage: http://www.fftw.org | |
| fmt | 3.0.2 4.1.0 | Description: fmt (formerly cppformat) is an open-source formatting library. Homepage: http://fmtlib.net/ | |
| foam-extend | 4.0 | Description: Homepage: | |
| freesurfer | 5.3.0 6.0.0 | Description: FreeSurfer is a software package for the analysis and visualization of structural and functional neuroimaging data from cross-sectional or longitudinal studies. It is developed by the Laboratory for Computational Neuroimaging at the Athinoula A. Martinos Center for Biomedical Imaging. Homepage: http://freesurfer.net/ | |
| gamess | 14Feb2018 | Description: Homepage: | |
| gc | 7.6.6 | Description: The Boehm-Demers-Weiser conservative garbage collector can be used as a garbage collecting replacement for C malloc or C++ new. Homepage: http://hboehm.info/gc/ | |
| gcc | 4.9.4 7.3.0 | Description: 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,...). Homepage: http://gcc.gnu.org/ | |
| gdb | 8.1 | ||
| git | 2.16.3 | Description: 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. Homepage: http://git-scm.com/ | |
| glib | 1.10.3 2.22.5 | ||
| g_mmpbsa | 5.1.2 | Description: G_MMPBSA calculates components of binding energy using MM-PBSA method except the entropic term and energetic contribution of each residue to the binding using energy decomposition scheme. - CC-Wiki: GROMACS Homepage: https://rashmikumari.github.io/g_mmpbsa/ | |
| gmp | 6.1.2 | Description: GMP is a free library for arbitrary precision arithmetic, operating on signed integers, rational numbers, and floating point numbers. Homepage: http://gmplib.org/ | |
| gnu-parallel | 20180322 | Description: Tools for running commands in parallel on one or more nodes. Homepage: https://www.gnu.org/software/parallel/ | |
| gnuplot | 5.2.2 | Description: Portable interactive, function plotting utility Homepage: http://gnuplot.sourceforge.net/ | |
| googletest | 1.8.0 | Description: Welcome to Google Test, Google-s C++ test framework! Please see the project page for more information as well as the mailing list for questions, discussions, and development. There is also an IRC channel on OFTC. Getting started information for Google Test is available in the Google Test Primer documentation. Google Mock is an extension to Google Test for writing and using C++ mock classes. See the separate Google Mock documentation. More detailed documentation for googletest (including build instructions) are in its interior googletest/README.md file. Homepage: https://github.com/google/googletest | |
| gromacs | 2016.5 2016.5-plumed-2.4.1 2019.1 5.1.4 | Description: GROMACS is a versatile package to perform molecular dynamics. i.e. simulating the Newtonian equations of motion for systems with hundreds to millions of particles. - CC-Wiki: GROMACS Homepage: http://www.gromacs.org | |
| gsl | 2.4 | Description: 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. Homepage: http://www.gnu.org/software/gsl/ | |
| guile | 2.2.3 | Description: Guile is the GNU Ubiquitous Intelligent Language for Extensions, the official extension language for the GNU operating system. Homepage: http://www.gnu.org/software/guile | |
| harminv | 1.4.1 | Description: Harminv is a free program (and accompanying library) to solve the problem of harmonic inversion - given a discrete-time, finite-length signal that consists of a sum of finitely-many sinusoids (possibly exponentially decaying) in a given bandwidth, it determines the frequencies, decay constants, amplitudes, and phases of those sinusoids. Homepage: http://ab-initio.mit.edu/wiki/index.php/Harminv | |
| hdf5 | 1.10.2 1.8.20 | Description: 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. Homepage: https://support.hdfgroup.org/HDF5/ | |
| hdf5-mpi | 1.10.2 1.8.20 | Description: 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. Homepage: https://support.hdfgroup.org/HDF5/ | |
| hisat2 | 2.1.0 | Description: 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). Homepage: https://ccb.jhu.edu/software/hisat2/index.shtml | |
| hpcx | 2.2-mofed-4.4 | Description: Homepage: | |
| hpn-ssh | 7.7p1-14v15 | Description: Homepage: | |
| htseq | 0.11.1 | Description: A framework to process and analyze data from high-throughput sequencing (HTS) assays Homepage: http://www-huber.embl.de/users/anders/HTSeq/ | |
| imake | 1.0.7 | Description: imake is a Makefile-generator that is intended to make it easier to develop software portably for multiple systems. Homepage: http://www.x.org/ | |
| intel | 2017.7 2018.1 2018.2 2018.3 | Description: Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL). Homepage: https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain | |
| intelmpi | 2017.7 2018.1 2018.2 2018.3 | Description: Intel's (MPICH-based) MPI implementation. Homepage: https://software.intel.com/en-us/intel-parallel-studio-xe | |
| intel-mpi-benchmarks | 2018.1 | Description: Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL). Homepage: https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain | |
| intelpython2 | 2018.2 | Description: Homepage: | |
| intelpython3 | 2018.2 | Description: Homepage: | |
| itk | 4.13.0 | Description: Insight Segmentation and Registration Toolkit (ITK) provides an extensive suite of software tools for registering and segmenting multidimensional imaging data. Homepage: https://itk.org | |
| java | 1.8.0_162 | Description: Java Platform, Standard Edition (Java SE) lets you develop and deploy Java applications on desktops and servers. Homepage: http://java.com/ | |
| julia | 1.0.0 1.1.0 | Description: A high-level, high-performance dynamic language for technical computing. Homepage: http://julialang.org | |
| lammps | 11May2018 22Sep2017 | Description: LAMMPS (Large-scale Atomic/Molecular Massively Parallel Simulator) is a classical molecular dynamics simulation. LAMMPS has potentials for solid-state materials (metals, semiconductors) and soft matter (biomolecules, polymers) and coarse-grained or mesoscopic systems. It can be used to model atoms or, more generically, as a parallel particle simulator at the atomic, meso, or continuum scale. It can be coupled to various programs. The following packages are not included within this version: GPU, KIM, KOKKOS, MSCG, USER-INTEL, USER-MISC, USER-QUIP, USER-VTK Homepage: http://lammps.sandia.gov/ | |
| libatomic_ops | 7.6.4 | Description: Homepage: | |
| libconfig | 1.7.2 | Description: Libconfig is a simple library for processing structured configuration files Homepage: http://www.hyperrealm.com/libconfig/ | |
| libctl | 4.0.1 4.1.2 | Description: libctl is a free Guile-based library implementing flexible control files for scientific simulations. Homepage: http://ab-initio.mit.edu/libctl | |
| libevent | 2.1.8 | Description: 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. Homepage: http://libevent.org/ | |
| libffi | 3.2.1 | Description: 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. Homepage: http://sourceware.org/libffi/ | |
| libint | 1.1.5 1.1.6 | Description: 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. Homepage: https://github.com/evaleev/libint | |
| libunistring | 0.9.9 | Description: This library provides functions for manipulating Unicode strings and for manipulating C strings according to the Unicode standard. Homepage: http://www.gnu.org/software/libunistring/ | |
| libxc | 3.0.0 4.0.3 4.0.5 | Description: 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. Homepage: http://www.tddft.org/programs/octopus/wiki/index.php/Libxc | |
| libxslt | 1.1.32 | Description: Libxslt is the XSLT C library developed for the GNOME project (but usable outside of the Gnome platform). Homepage: http://xmlsoft.org/ | |
| libxsmm | 1.9 | Description: LIBXSMM is a library for small dense and small sparse matrix-matrix multiplications targeting Intel Architecture (x86). Homepage: https://github.com/hfp/libxsmm | |
| libyaml | 0.1.7 | Description: LibYAML is a YAML 1.1 parser and emitter written in C. Homepage: http://pyyaml.org/wiki/LibYAML | |
| lmdb | 0.9.22 | Description: OpenLDAP's Lightning Memory-Mapped Database (LMDB) library. Homepage: https://github.com/LMDB/lmdb | |
| makedepend | 1.0.5 | Description: The makedepend package contains a C-preprocessor like utility to determine build-time dependencies. Homepage: http://www.linuxfromscratch.org/blfs/view/svn/x/makedepend.html | |
| mcl | 14-137 | Description: The MCL algorithm is short for the Markov Cluster Algorithm, a fast and scalable unsupervised cluster algorithm for graphs (also known as networks) based on simulation of (stochastic) flow in graphs. Homepage: http://micans.org/mcl/ | |
| mcr | R2018a | Description: The MATLAB Runtime is a standalone set of shared libraries that enables the execution of compiled MATLAB applications or components on computers that do not have MATLAB installed. Homepage: http://www.mathworks.com/products/compiler/mcr/ | |
| meep | 1.4.3 1.5.0 | Description: Meep (or MEEP) is a free finite-difference time-domain (FDTD) simulation software package developed at MIT to model electromagnetic systems. Homepage: http://ab-initio.mit.edu/wiki/index.php/Meep | |
| meep-mpi | 1.4.3 1.5.0 | Description: Meep (or MEEP) is a free finite-difference time-domain (FDTD) simulation software package developed at MIT to model electromagnetic systems. Homepage: http://ab-initio.mit.edu/wiki/index.php/Meep | |
| mercurial | 4.6 | Description: Mercurial is a free, distributed source control management tool. It efficiently handles projects of any size and offers an easy and intuitive interface. Homepage: http://mercurial.selenic.com/ | |
| metis | 4.0.3 5.1.0 | Description: 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. Homepage: http://glaros.dtc.umn.edu/gkhome/metis/metis/overview | |
| mkl | 2017.7 2018.2 2018.2.lua 2018.3 | Description: Intel's Math Kernel Library, for use with gcc modules (the intel modules include mkl already). Homepage: http://software.intel.com/en-us/intel-mkl/ | |
| mmseqs2 | 7-4e23d | Description: MMseqs2: ultra fast and sensitive search and clustering suite Homepage: https://mmseqs.com | |
| mosh | 1.3.2 | Description: Homepage: | |
| mpb | 1.6.2 | Description: Homepage: | |
| mpb-mpi | 1.6.2 | Description: Homepage: | |
| mpfr | 4.0.1 | Description: The MPFR library is a C library for multiple-precision floating-point computations with correct rounding. Homepage: http://www.mpfr.org | |
| mumps | 5.1.2 | ||
| mysql | 8.0.13 | Description: MySQL is one of the world's most widely used open-source relational database management system (RDBMS). Homepage: http://www.mysql.com/ | |
| namd | 2.13 | Description: NAMD is a parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems. Homepage: http://www.ks.uiuc.edu/Research/namd/ | |
| ncl | 6.4.0 | Description: NCL is an interpreted language designed specifically for scientific data analysis and visualization. Homepage: http://www.ncl.ucar.edu | |
| nco | 4.7.4 4.7.6 | ||
| ncview | 2.1.7 | Description: Ncview is a visual browser for netCDF format files. Typically you would use ncview to get a quick and easy, push-button look at your netCDF files. You can view simple movies of the data, view along various dimensions, take a look at the actual data values, change color maps, invert the data, etc. Homepage: http://meteora.ucsd.edu/~pierce/ncview_home_page.html | |
| netcdf | 1.9.0 4.6.1 | Description: 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. Homepage: http://www.unidata.ucar.edu/software/netcdf/ | |
| netcdf-mpi | 4.6.1 | Description: 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. Homepage: http://www.unidata.ucar.edu/software/netcdf/ | |
| neuron | 7.6.2 | Description: Empirically-based simulations of neurons and networks of neurons. Homepage: http://www.neuron.yale.edu/neuron | |
| octave | 4.4.0 | Description: GNU Octave is a high-level interpreted language, primarily intended for numerical computations. Homepage: http://www.gnu.org/software/octave/ | |
| openblas | 0.2.20 | Description: OpenBLAS is an optimized BLAS library based on GotoBLAS2 1.13 BSD version. Homepage: http://xianyi.github.com/OpenBLAS/ | |
| openfoam | 17.12 18.06 18.12 4.1 5.0 5.0-debug 6 | Description: 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. Homepage: http://www.openfoam.org/ | |
| openmpi | 1.10.7 2.1.3 2.1.4 3.0.1 3.0.2 3.1.0 3.1.0rc3 3.1.0rc4 3.1.1 | Description: The Open MPI Project is an open source MPI-3 implementation. Homepage: http://www.open-mpi.org/ | |
| orthofinder | 2.2.7 | Description: Homepage: | |
| osu-micro-benchmarks | 5.4.3 | Description: Homepage: | |
| paraview | 5.5.0 | ||
| paraview-offscreen | 5.6.0 | ||
| parmetis | 4.0.3 | Description: 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. Homepage: http://glaros.dtc.umn.edu/gkhome/metis/parmetis/overview | |
| perf-reports | 18.2 | Description: Homepage: | |
| perl | 5.20.3 5.26.1 | ||
| petsc | 3.8.4 3.8.4-debug 3.9.2 | Description: 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. Homepage: http://www.mcs.anl.gov/petsc | |
| pgplot | 5.2.2 5.2.2-x | Description: The PGPLOT Graphics Subroutine Library is a Fortran- or C-callable, device-independent graphics package for making simple scientific graphs. It is intended for making graphical images of publication quality with minimum effort on the part of the user. For most applications, the program can be device-independent, and the output can be directed to the appropriate device at run time. Homepage: http://www.astro.caltech.edu/~tjp/pgplot/ | |
| pism | 1.0 | Description: Homepage: | |
| plink | 1.07 | Description: plink-1.9-x86_64: Whole-genome association analysis toolset Homepage: https://www.cog-genomics.org/plink/1.9/ | |
| plumed | 2.4.1 | Description: 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. Homepage: http://www.plumed-code.org | |
| pnetcdf | 1.9.0 | Description: PnetCDF is a high-performance parallel I/O library for accessing files in format compatibility with Unidata's NetCDF, specifically the formats of CDF-1, 2, and 5. The CDF-5 file format, an extension of CDF-2, supports unsigned data types and uses 64-bit integers to allow users to define large dimensions, attributes, and variables (> 2B array elements). Homepage: https://trac.mcs.anl.gov/projects/parallel-netcdf | |
| protobuf | 3.6.1 | ||
| python | 2.7.14 2.7.15 3.6.5 | Description: Python is a programming language that lets you work more quickly and integrate your systems more effectively. Homepage: http://python.org/ | |
| qbatch | 2.1 | Description: Homepage: | |
| qhull | 2015.2 | Description: 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. Homepage: http://www.qhull.org | |
| qt | 5.11.1 | ||
| quantum-espresso | 6.2.1 6.3 | Description: Homepage: | |
| r | 1.1.1 2.2.7 2.6.1b 2.7.7 3.5.0 3.5.1 4.0.1 5.3.0 6.0.0 R2018a | Description: R is a free software environment for statistical computing and graphics. Homepage: http://www.r-project.org/ | |
| rarray | 1.2 | Description: Homepage: | |
| rsync | 3.1.3 | Description: Utility that provides fast incremental file transfer; this module provides a newer version than is present in the operating system. Homepage: https://rsync.samba.org/ | |
| rtk | 1.4.0 | Description: Insighteconstruction Toolkit (RTK) is an open-source and cross-platform software for fast circular cone-beam CT reconstruction based on the Insight Toolkit (ITK). RTK is developped by the RTK consortium. RTK provides or will provide Basic operators for reconstruction, e.g., filtering, forward, projection and backprojection Multithreaded CPU and GPU versions Tools for respiratory motion correction I/O for several scanners Preprocessing of raw data for scatter correction Homepage: https://itk.org | |
| rust | 1.26.1 1.28.0 | Description: Rust is a systems programming language that runs blazingly fast, prevents segfaults, and guarantees thread safety. Homepage: https://www.rust-lang.org | |
| samtools | 1.8 | Description: SAM Tools provide various utilities for manipulating alignments in the SAM format, including sorting, merging, indexing and generating alignments in a per-position format. Homepage: http://www.htslib.org/ | |
| scalapack | 2.0.2 | Description: The ScaLAPACK (or Scalable LAPACK) library includes a subset of LAPACK routines redesigned for distributed memory MIMD parallel computers. Homepage: http://www.netlib.org/scalapack/ | |
| scons | 3.0.1 | ||
| scotch | 6.0.6 | Description: Software package and libraries for sequential and parallel graph partitioning, static mapping, and sparse matrix block ordering, and sequential mesh and hypergraph partitioning. Homepage: http://gforge.inria.fr/projects/scotch/ | |
| shengbte | 1.1.1 | Description: ShengBTE is a software package for solving the Boltzmann Transport Equation for phonons. Also installed is the 'thirdorder' package of Python scripts. Homepage: http://www.shengbte.org/ | |
| silo | 4.10.2-bsd | Description: Silo is a library for reading and writing a wide variety of scientific data to binary, disk files Homepage: https://wci.llnl.gov/codes/silo/ | |
| singularity | 2.lua | Description: Singularity is a portable application stack packaging and runtime utility. Homepage: http://singularity.lbl.gov | |
| spades | 3.13.0 | Description: Genome assembler for single-cell and isolates data sets Homepage: http://bioinf.spbau.ru/en/spades | |
| spglib | 1.10.3 | Description: Spglib is a C library for finding and handling crystal symmetries. Homepage: https://github.com/atztogo/spglib | |
| sqlite | 3.23.0 | ||
| stacks | 2.2 | Description: Stacks is a software pipeline for building loci from short-read sequences, such as those generated on the Illumina platform. Stacks was developed to work with restriction enzyme-based data, such as RAD-seq, for the purpose of building genetic maps and conducting population genomics and phylogeography. Homepage: http://creskolab.uoregon.edu/stacks/ | |
| star | 2.6.1b | Description: STAR aligns RNA-seq reads to a reference genome using uncompressed suffix arrays. Homepage: https://github.com/alexdobin/STAR | |
| stringtie | 1.3.5 | Description: StringTie is a fast and highly efficient assembler of RNA-Seq alignments into potential transcripts. Homepage: http://ccb.jhu.edu/software/stringtie/ | |
| su2 | 5.0.0 6.0.0 6.1.0 | Description: An open-source collection of software tools written in C++ for performing Partial Differential Equation (PDE) analysis and solving PDE-constrained optimization problems. The toolset is designed with computational fluid dynamics and aerodynamic shape optimization in mind. Homepage: http://su2.stanford.edu | |
| subversion | 1.9.7 | Description: Subversion is an open source version control system. Homepage: http://subversion.apache.org/ | |
| sundials | 2.6.0 2.7.0 3.1.0 | Description: SUNDIALS: SUite of Nonlinear and DIfferential/ALgebraic Equation Solvers Homepage: http://computation.llnl.gov/projects/sundials | |
| sundials-mpi | 3.1.0 | Description: SUNDIALS: SUite of Nonlinear and DIfferential/ALgebraic Equation Solvers Homepage: http://computation.llnl.gov/projects/sundials | |
| swig | 3.0.12 | Description: SWIG is a software development tool that connects programs written in C and C++ with a variety of high-level programming languages. Homepage: http://www.swig.org/ | |
| thirdorder | 1.1.1 | Description: Homepage: | |
| trilinos | 12.12.1 | Description: 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. Homepage: https://trilinos.org | |
| trinityrnaseq | 2.8.1 | Description: Homepage: | |
| udunits | 2.2.26 | Description: UDUNITS supports conversion of unit specifications between formatted and binary forms, arithmetic manipulation of units, and conversion of values between compatible scales of measurement. Homepage: http://www.unidata.ucar.edu/software/udunits/ | |
| valgrind | 3.13.0 3.14.0 | ||
| visit | 2.13.1 | Description: VisIt is an Open Source, interactive, scalable, visualization, animation and analysis tool. Homepage: https://wci.llnl.gov/simulation/computer-codes/visit | |
| vmd | 1.9.4a12 | Description: VMD is a molecular visualization program for displaying, animating, and analyzing large biomolecular systems using 3-D graphics and built-in scripting. Homepage: http://www.ks.uiuc.edu/Research/vmd | |
| vtk | 8.1.1 | Description: 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. Homepage: http://www.vtk.org |