# PKGBUILD for HOOMD-blue. This pulls from git, but uses the "maint" version. # Maintainer: Asmund Ervik pkgname=hoomd-blue pkgver=v2.2.2.r1.g6e386396a pkgrel=1 pkgdesc="A general-purpose particle simulation toolkit using GPUs with CUDA" arch=('any') url="http://codeblue.umich.edu/hoomd-blue/index.html" license=('custom: University of Michigan "MIT-Like"') depends=(python boost cuda cmake openmpi gcc6) makedepends=(git) optdepends=('nvidia: running simulations on GPU') provides=(hoomd-blue) source=(hoomd-blue::git+https://bitbucket.org/glotzer/hoomd-blue#branch=maint) md5sums=('SKIP') pkgver() { cd "$pkgname" git describe --long | sed -r 's/([^-]*-g)/r\1/;s/-/./g' } build() { cd "$srcdir/$pkgname" mkdir -p build && cd build export CC=gcc-6 export CXX=g++-6 cmake ../ -DCMAKE_INSTALL_PREFIX=/usr -DCMAKE_BUILD_TYPE=Release \ -DCMAKE_CXX_FLAGS=-march=native -DCMAKE_C_FLAGS=-march=native \ -DENABLE_CUDA=ON -DENABLE_MPI=ON -DSINGLE_PRECISION=ON \ -DCUDA_TOOLKIT_ROOT_DIR=/opt/cuda } package() { # Install the license mkdir -p "$pkgdir/usr/share/licenses/$pkgname" cp "$srcdir/$pkgname/LICENSE" "$pkgdir/usr/share/licenses/$pkgname/" # Install the software cd "$srcdir/$pkgname/build" make DESTDIR="$pkgdir" install -j8 # Patch some lines that reference the source build directory sed -i 's/HOOMD_SOURCE_DIR.*/HOOMD_SOURCE_DIR "\/usr\/include\/hoomd"/' "$pkgdir/usr/hoomd/include/HOOMDVersion.h" sed -i 's/HOOMD_BINARY_DIR.*/HOOMD_BINARY_DIR "\/usr\/bin"/' "$pkgdir/usr/hoomd/include/HOOMDVersion.h" # Uncomment this if you want to test the install (takes quite a long time): #make check -j8 }