diff options
Diffstat (limited to 'PKGBUILD')
| -rw-r--r-- | PKGBUILD | 19 |
1 files changed, 8 insertions, 11 deletions
@@ -1,20 +1,19 @@ pkgname=openmm -pkgver=7.3.1 +pkgver=7.4.2 pkgrel=1 pkgdesc="Toolkit for molecular simulation using high performance GPU code" -arch=('i686' 'x86_64') +arch=('x86_64') url="http://openmm.org/" license=('MIT' 'LGPL') depends=('fftw') -makedepends=('cmake' 'swig' 'doxygen') +optdepends=('cuda: prrovides cuda support') +makedepends=('cmake' 'swig' 'doxygen' 'cython') source=("https://github.com/pandegroup/openmm/archive/${pkgver}.tar.gz") -sha1sums=('3e2d18d033dbe8bb52867ac1232afb6788bff346') +sha256sums=('2e121ad5cfcc4840861032bb1b11d4d0aea2d3ca3c59baaed73b8b0b4fd069cc') -#prepare() { -# cd "${srcdir}"/openmm-${pkgver} -# patch -p1 -i "${srcdir}"/01ae387d649c959812bb3d3bc451e54746b2ab59.patch -# sed -i "s|sys.argv\[0\]|os.path.basename(sys.argv\[0\])|g" wrappers/python/src/swig_doxygen/swigInputBuilder.py -#} +export CC=gcc-9 +export CXX=g++-9 +export FC=gfortran-9 build() { cd "${srcdir}" @@ -41,8 +40,6 @@ package() { install -d "${pkgdir}"/usr/share/licenses/${pkgname} msg2 "Installing openmm python bindings" - # Fix to install python wrapper - #sed -i 's:setup.py install:setup.py install --root=$DESTDIR:g' wrappers/python/pysetupinstall.cmake make DESTDIR="${pkgdir}" PythonInstall mv "${pkgdir}"/usr/licenses/*.txt "${pkgdir}"/usr/share/licenses/${pkgname} rm -rf "${pkgdir}"/usr/{bin,docs,examples,licenses} |