diff options
| -rw-r--r-- | .SRCINFO | 9 | ||||
| -rw-r--r-- | PKGBUILD | 12 |
2 files changed, 9 insertions, 12 deletions
@@ -1,17 +1,16 @@ pkgbase = gromacs-4.6-complete - pkgdesc = GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. + 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 = 4.6.7 pkgrel = 7 url = http://www.gromacs.org/ arch = i686 arch = x86_64 - license = GPL - depends = gcc5 + license = LGPL + makedepends = doxygen depends = fftw - depends = perl depends = libxml2 depends = libsm - depends = doxygen + optdepends = perl: needed for demux.pl and xplor2gmx.pl options = !libtool source = ftp://ftp.gromacs.org/pub/gromacs/gromacs-4.6.7.tar.gz source = GMXRC.bash.cmakein.patch @@ -3,11 +3,13 @@ pkgname=gromacs-4.6-complete pkgver=4.6.7 pkgrel=7 -pkgdesc='GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles.' +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=("GPL") +license=("LGPL") arch=('i686' 'x86_64') -depends=('gcc5' 'fftw' 'perl' 'libxml2' 'libsm' 'doxygen') +depends=('fftw' 'libxml2' 'libsm') +optdepends=('perl: needed for demux.pl and xplor2gmx.pl') +makedepends=('doxygen') options=('!libtool') source=(ftp://ftp.gromacs.org/pub/gromacs/gromacs-${pkgver}.tar.gz GMXRC.bash.cmakein.patch) @@ -20,10 +22,6 @@ export VMDDIR=/usr/lib/vmd/ #If vmd is available at compilation time #trajectory file format that can be read by #VMD installation (e.g. AMBER's DCD format). -#With gcc5 currently there are less errors in the tests -# also the compilation is possible in cuda capable machines -#export CC=gcc-5 -#export CXX=g++-5 prepare() { cd ${srcdir}/gromacs-${pkgver}/scripts/ |