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ape
A tool for generating atomic pseudopotentials within a Density-Functional Theory framework.
Version: 2.3.1 | Maintained by: dstrubbe | Categories: science | Variants: gcc10, gcc11, gcc5, gcc6, gcc7, gcc8, gcc9, gccdevel, gfortranberkeleygw
GW/Bethe-Salpeter equation
Version: 2.0.0 | Maintained by: dstrubbe | Categories: science | Variants: accelerate, atlas, openblas, clang10, clang11, clang12, clang13, clang14, clang15, clang16, clang17, clang50, clang60, clang70, clang80, clang90, clangdevel, gcc10, gcc11, gcc12, gcc13, gccdevel, gfortran, mpich, openmpi, threads, debug, hdf5, fftw2etsf_io
A library of F90 routines to read/write the ETSF_IO file format.
Version: 1.0.4 | Maintained by: dstrubbe | Categories: science | Variants: g95, gcc10, gcc11, gcc5, gcc6, gcc7, gcc8, gcc9, gccdevelfeast
A free high-performance numerical library for solving Hermitian and non-Hermitian eigenvalue problems
Version: 4.0 | Maintained by: dstrubbe | Categories: science | Variants: clang10, clang11, clang90, gcc10, gcc7, gcc9, gfortran, mpich, openmpigromacs
Molecular dynamics package designed for simulations of proteins, lipids, and nucleic acids.
Version: 2021.3 | Maintained by: dstrubbe | Categories: science math | Variants: debug, accelerate, atlas, openblas, x11, threads, clang10, clang11, clang12, clang13, clang14, clang15, clang16, clang17, clang50, clang60, clang70, clang80, clang90, clangdevel, gcc10, gcc11, gcc12, gcc13, gccdevel, mpich, openmpi, double, universalgromacs-plumed
Molecular dynamics package designed for simulations of proteins, lipids, and nucleic acids.: (THIS PORT INSTALLS A VERSION OF GROMACS PATCHED WITH PLUMED)
Version: 2021.3 | Maintained by: dstrubbe | Categories: science math | Variants: debug, accelerate, atlas, openblas, x11, threads, clang10, clang11, clang12, clang13, clang14, clang15, clang16, clang17, clang50, clang60, clang70, clang80, clang90, clangdevel, gcc10, gcc11, gcc12, gcc13, gccdevel, mpich, openmpi, double, universalhpl
High Performance Computing Linpack Benchmark
Version: 2.3 | Maintained by: dstrubbe | Categories: science | Variants: accelerate, atlas, openblas, clang10, clang11, clang12, clang13, clang14, clang15, clang16, clang17, clang90, gcc10, gcc11, gcc12, gcc13, mpich, openmpilibtcd
API for using Tide Constituent Database files
Version: 2.2.7-r2 | Maintained by: dstrubbe | Categories: science | Variants: universallibxc
exchange-correlation functionals for DFT
Version: 2.2.3 | Maintained by: dstrubbe | Categories: science | Variants: g95, gcc10, gcc11, gcc12, gccdevellibxc4
exchange-correlation functionals for DFT
Version: 4.3.4 | Maintained by: dstrubbe | Categories: science | Variants: gcc10, gcc11, gcc12, gccdeveloctopus
A real-space (time-dependent) density-functional theory code.
Version: 12.1 | Maintained by: dstrubbe | Categories: science | Variants: accelerate, atlas, openblas, gcc10, gcc11, gcc12, gcc13, gccdevel, mpich, openmpi, threads, netcdf, etsf_io, sparskit, gdlib, scalapack, arpack, parpack, parmetis, berkeleygw, everything_serial, everything, maxdim4OpenCSG
OpenCSG is a library that does image-based CSG rendering using OpenGL
Version: 1.4.2 | Maintained by: dstrubbe | Categories: science cad | Variants: debugopenscad
Software for creating solid 3D CAD objects
Version: 2021.01 | Maintained by: dstrubbe | Categories: science cad | Variants: debugopenscad-devel
Software for creating solid 3D CAD objects
Version: 2021.01 | Maintained by: dstrubbe | Categories: science cad | Variants: debugparaview
3D data analysis and visualization application
Version: 5.6.2 | Maintained by: jjstickel, dstrubbe | Categories: graphics science | Variants: debug, g95, mpich, openmpi, python27, python35, python36, python37, ffmpeg, xdmf, testingpfft
An extension of FFTW to massively parallel architectures
Version: 1.0.8-alpha | Maintained by: dstrubbe | Categories: math | Variants: clang10, clang11, clang90, g95, gcc10, gcc7, gcc9, gfortran, mpich, openmpi, universalpy-pyslides
Python-based tool for presentation-ready slides
Version: 0.9.38 | Maintained by: dstrubbe | Categories: graphics python | Variants:py-selenium
Python language bindings for Selenium WebDriver
Version: 4.3.0 | Maintained by: dstrubbe | Categories: python | Variants:py27-pyslides
Python-based tool for presentation-ready slides
Version: 0.9.38 | Maintained by: dstrubbe | Categories: graphics python | Variants:py310-selenium
Python language bindings for Selenium WebDriver
Version: 4.3.0 | Maintained by: dstrubbe | Categories: python | Variants:32 port(s) found
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