diff options
| -rw-r--r-- | var/spack/repos/builtin/packages/py-mdanalysis/package.py | 46 |
1 files changed, 36 insertions, 10 deletions
diff --git a/var/spack/repos/builtin/packages/py-mdanalysis/package.py b/var/spack/repos/builtin/packages/py-mdanalysis/package.py index a419dff426..0651123ef3 100644 --- a/var/spack/repos/builtin/packages/py-mdanalysis/package.py +++ b/var/spack/repos/builtin/packages/py-mdanalysis/package.py @@ -16,6 +16,8 @@ class PyMdanalysis(PythonPackage): homepage = "http://www.mdanalysis.org" url = "https://pypi.io/packages/source/M/MDAnalysis/MDAnalysis-0.19.2.tar.gz" + version('1.0.0', sha256='f45a024aca45e390ff1c45ca90beb2180b78881be377e2a1aa9cd6c109bcfa81') + version('0.20.1', sha256='d04b71b193b9716d2597ffb9938b93f43487fa535da1bb5c1f2baccf356d7df9') version('0.19.2', sha256='c5395bbafa5efca2e1aee4715d26129844140c47cb8301da0293106cb969de7d') version('0.19.1', sha256='ff1d694f8598c0833ec340de6a6adb3b5e62b92d0fa94ee6401718ba972db3cc') version('0.19.0', sha256='248e3b37fc6150e31c609cc18a3927c32aee37b76d29cbfedf635e7e1aa982cf') @@ -31,18 +33,42 @@ class PyMdanalysis(PythonPackage): variant('amber', default=False, description='Support AMBER netcdf format.') - depends_on('python@2.7:') - depends_on('py-setuptools', type='build') + depends_on('python@2.7:', type=('build', 'run')) + + depends_on('py-setuptools', type='build') depends_on('py-cython@0.16:', type='build') - depends_on('py-numpy@1.5.0:', type=('build', 'run')) - depends_on('py-six@1.4.0:', type=('build', 'run')) - depends_on('py-biopython@1.59:', type=('build', 'run')) + + depends_on('py-six@1.4.0:', type=('build', 'run')) depends_on('py-networkx@1.0:', type=('build', 'run')) - depends_on('py-griddataformats@0.3.2:', type=('build', 'run')) - depends_on('py-matplotlib', when='+analysis', type=('build', 'run')) - depends_on('py-scipy', when='+analysis', type=('build', 'run')) - depends_on('py-seaborn', when='+analysis', type=('build', 'run')) + depends_on('py-gsd@1.4.0:', when='@1.17.0:', type=('build', 'run')) + depends_on('py-mmtf-python@1.0.0:', when='@0.16.0:', type=('build', 'run')) + depends_on('py-mock', when='@0.18.0:', type=('build', 'run')) + depends_on('py-tqdm@4.43.0:', when='@1.0.0:', type=('build', 'run')) + + depends_on('py-joblib', when='@0.16.0:0.20.1', type=('build', 'run')) + depends_on('py-joblib@0.12:', when='@1.0.0:', type=('build', 'run')) + + depends_on('py-numpy@1.5.0:', when='@:0.15.0', type=('build', 'run')) + depends_on('py-numpy@1.10.4:', when='@0.16.0:0.19.2', type=('build', 'run')) + depends_on('py-numpy@1.13.3:', when='@0.20.1:', type=('build', 'run')) + + depends_on('py-biopython@1.59:', when='@:0.17.0', type=('build', 'run')) + depends_on('py-biopython@1.71:', when='@0.18.0:', type=('build', 'run')) + + depends_on('py-griddataformats@0.3.2:', when='@:0.16.2', type=('build', 'run')) + depends_on('py-griddataformats@0.4:', when='@0.17.0:', type=('build', 'run')) + + depends_on('py-matplotlib', when='@:0.15.0+analysis', type=('build', 'run')) + depends_on('py-matplotlib@1.5.1:', when='@0.16.0:0.16.1+analysis', type=('build', 'run')) + depends_on('py-matplotlib@1.5.1:', when='@0.16.2:', type=('build', 'run')) + + depends_on('py-scipy', when='@:0.16.1+analysis', type=('build', 'run')) + depends_on('py-scipy', when='@0.16.2:0.17.0', type=('build', 'run')) + depends_on('py-scipy@1.0.0:', when='@0.18.0:', type=('build', 'run')) + + depends_on('py-scikit-learn', when='@0.16.0:+analysis', type=('build', 'run')) + depends_on('py-seaborn', when='+analysis', type=('build', 'run')) depends_on('py-netcdf4@1.0:', when='+amber', type=('build', 'run')) - depends_on('hdf5', when='+amber', type=('run')) + depends_on('hdf5', when='+amber', type=('run')) |