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pkgbase = plumed-mpi
pkgdesc = An open source plugin for free energy calculations in molecular systems which works together with some of the most popular molecular dynamics engines (with MPI support)
pkgver = 2.8.2
pkgrel = 1
url = http://www.plumed.org/
arch = i686
arch = x86_64
license = GPL
makedepends = vim
depends = lapack
depends = zlib
depends = gsl
depends = openmpi
depends = netcdf
optdepends = vmd-molfile-plugins: add capability to read vmd compatible trajectories
optdepends = xdrfile: GROMACS trajectory format support
optdepends = python-setuptools: Python module support
optdepends = cython: Python module support
optdepends = graphviz: diagrams in manual
optdepends = gawk: partial tempering support
source = https://github.com/plumed/plumed2/releases/download/v2.8.2/plumed-2.8.2.tgz
sha256sums = 93a2779ce0abfcf6c29ed7db95a062912603e05bc46c56f5785f7eaf6a1bea23
pkgname = plumed-mpi
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