INFO
Name: gromacs
Version: 2019.6-2.el8
Arch: aarch64
Summary: Fast, Free and Flexible Molecular Dynamics
License: GPLv2+
Vendor: Fedora Project
Build Host: buildvm-a64-05.iad2.fedoraproject.org
Build Date: Sat May 22 19:21:11 2021
Size: 113824643
URL: http://www.gromacs.org
Description: GROMACS is a versatile and extremely well optimized package to perform
molecular dynamics computer simulations and subsequent trajectory analysis.
It is developed for bio-molecules like proteins, but the extremely high
performance means it is used also in several other field like polymer chemistry
and solid state physics.
This package provides single and double precision binaries.
The documentation is in the package gromacs-common.
mdrun has been compiled with thread parallellization, so it runs in parallel
on shared memory systems. If you want to run on a cluster, you probably want
to install one of the MPI parallellized packages.
N.B. All binaries have names starting with g_, for example mdrun has been
renamed to g_mdrun.
FILES
gromacs-2019.6.tar.gz
gromacs-README.fedora
gromacs-dssp-path.patch
gromacs-issue-2366.patch
gromacs.spec
manual-2019.6.pdf
regressiontests-2019.6.tar.gz
REQUIRES
bash-completion
cmake 3.4.3
fftw-devel
gcc-c++
gsl-devel
hwloc
hwloc-devel
libX11-devel
lmfit-devel 6.0
mpich-devel
ocl-icd-devel
openblas-devel
opencl-headers
openmpi-devel
rpmlib(CompressedFileNames) 3.0.4-1
rpmlib(FileDigests) 4.6.0-1
tng-devel
PROVIDES
CONFIG FILES
gromacs-2019.6.tar.gz
gromacs-README.fedora
gromacs-dssp-path.patch
gromacs-issue-2366.patch
gromacs.spec s
manual-2019.6.pdf
regressiontests-2019.6.tar.gz
LICENSE FILES
GPLv2+
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