diff options
| -rw-r--r-- | .SRCINFO | 14 | ||||
| -rw-r--r-- | PKGBUILD | 11 |
2 files changed, 17 insertions, 8 deletions
@@ -1,19 +1,23 @@ pkgbase = gromacs pkgdesc = A versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. pkgver = 2016.3 - pkgrel = 1 + pkgrel = 2 url = http://www.gromacs.org/ arch = i686 arch = x86_64 license = LGPL makedepends = cmake - depends = blas + makedepends = libxml2 + makedepends = hwloc + makedepends = gcc5 depends = lapack - depends = cblas depends = zlib - depends = hwloc depends = libx11 - depends = gcc5 + optdepends = cuda: Nvidia GPU support + optdepends = openmotif: needed for gmx view + optdepends = perl: needed for demux.pl and xplor2gmx.pl + optdepends = opencl-mesa: OpenCL support for AMD GPU + optdepends = opencl-nvidia: OpenCL support for Nvidia GPU options = !libtool source = ftp://ftp.gromacs.org/pub/gromacs/gromacs-2016.3.tar.gz sha1sums = 1ae1ea922b94c74f43ee066e3ea64bafa1c6c3b6 @@ -3,13 +3,18 @@ pkgname=gromacs pkgver=2016.3 -pkgrel=1 +pkgrel=2 pkgdesc='A versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles.' url='http://www.gromacs.org/' license=("LGPL") arch=('i686' 'x86_64') -depends=('blas' 'lapack' 'cblas' 'zlib' 'hwloc' 'libx11' 'gcc5') -makedepends=('cmake') +depends=('lapack' 'zlib' 'libx11') +optdepends=('cuda: Nvidia GPU support' + 'openmotif: needed for gmx view' + 'perl: needed for demux.pl and xplor2gmx.pl' + 'opencl-mesa: OpenCL support for AMD GPU' + 'opencl-nvidia: OpenCL support for Nvidia GPU') +makedepends=('cmake' 'libxml2' 'hwloc' 'gcc5') options=('!libtool') source=(ftp://ftp.gromacs.org/pub/gromacs/${pkgname}-${pkgver}.tar.gz) sha1sums=('1ae1ea922b94c74f43ee066e3ea64bafa1c6c3b6') |