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| author | Christoph Junghans <junghans@lanl.gov> | 2022-02-21 10:23:00 -0700 |
|---|---|---|
| committer | GitHub <noreply@github.com> | 2022-02-21 09:23:00 -0800 |
| commit | 9173fd7c61ef8a25dbe9d18717fcaf1dddcb52cd (patch) | |
| tree | 45f52049b5d0d91d8f95c2143906cd5b31fcc7a9 | |
| parent | 275608e2f2abb8b5423d89fd8c951876cde8e6cd (diff) | |
| download | spack-9173fd7c61ef8a25dbe9d18717fcaf1dddcb52cd.tar.gz spack-9173fd7c61ef8a25dbe9d18717fcaf1dddcb52cd.tar.bz2 spack-9173fd7c61ef8a25dbe9d18717fcaf1dddcb52cd.tar.xz spack-9173fd7c61ef8a25dbe9d18717fcaf1dddcb52cd.zip | |
votca: fix git url and allow build without xtp parts (#29056)
* votca: fix git url
* Votca: add xtp variant
| -rw-r--r-- | var/spack/repos/builtin/packages/votca/package.py | 18 |
1 files changed, 11 insertions, 7 deletions
diff --git a/var/spack/repos/builtin/packages/votca/package.py b/var/spack/repos/builtin/packages/votca/package.py index a93618708c..983335774f 100644 --- a/var/spack/repos/builtin/packages/votca/package.py +++ b/var/spack/repos/builtin/packages/votca/package.py @@ -15,7 +15,7 @@ class Votca(CMakePackage): """ homepage = "https://www.votca.org" url = "https://github.com/votca/votca/tarball/v2022-rc.1" - git = "https://github.com/votca/xtp.git" + git = "https://github.com/votca/votca.git" maintainers = ['junghans'] version('master', branch='master') @@ -24,6 +24,7 @@ class Votca(CMakePackage): variant('mkl', default=False, description='Build with MKL support') variant('new-gmx', default=False, description='Build against gromacs>2019 - no tabulated kernels') + variant('xtp', default=True, description='Build xtp parts of votca') conflicts('votca-tools') conflicts('votca-csg') conflicts('votca-xtp') @@ -34,14 +35,17 @@ class Votca(CMakePackage): depends_on("eigen@3.3:") depends_on("boost") depends_on('mkl', when='+mkl') - depends_on("libxc") depends_on("hdf5+cxx~mpi") - depends_on("libint@2.6.0:") - depends_on("libecpint") - depends_on("py-h5py") - depends_on("py-lxml") depends_on("gromacs~mpi@5.1:") depends_on("gromacs~mpi@5.1:2019", when="~new-gmx") + + with when('+xtp'): + depends_on("libxc") + depends_on("libint@2.6.0:") + depends_on("libecpint") + depends_on("py-h5py") + depends_on("py-lxml") + depends_on('lammps', type='test') depends_on('py-espresso', type='test') depends_on('py-pytest', type='test') @@ -49,7 +53,7 @@ class Votca(CMakePackage): def cmake_args(self): args = [ '-DINSTALL_RC_FILES=OFF', - '-DBUILD_XTP=ON', + self.define_from_variant('BUILD_XTP', 'xtp'), '-DBUILD_CSGAPPS=ON', ] |