diff options
Diffstat (limited to 'var/spack/repos/builtin/packages/votca-tools/package.py')
| -rw-r--r-- | var/spack/repos/builtin/packages/votca-tools/package.py | 119 |
1 files changed, 87 insertions, 32 deletions
diff --git a/var/spack/repos/builtin/packages/votca-tools/package.py b/var/spack/repos/builtin/packages/votca-tools/package.py index 11a9056d7a..2e64bd4448 100644 --- a/var/spack/repos/builtin/packages/votca-tools/package.py +++ b/var/spack/repos/builtin/packages/votca-tools/package.py @@ -9,54 +9,109 @@ from spack.package import * class VotcaTools(CMakePackage): """Versatile Object-oriented Toolkit for Coarse-graining - Applications (VOTCA) is a package intended to reduce the amount of - routine work when doing systematic coarse-graining of various - systems. The core is written in C++. + Applications (VOTCA) is a package intended to reduce the amount of + routine work when doing systematic coarse-graining of various + systems. The core is written in C++. - This package contains the basic tools library of VOTCA. + This package contains the basic tools library of VOTCA. """ + homepage = "https://www.votca.org" - url = "https://github.com/votca/tools/tarball/v1.4" - git = "https://github.com/votca/tools.git" - maintainers = ['junghans'] - - version('stable', branch='stable', deprecated=True) - version('2021.2', sha256='2cd3175b65924803aff90dce49f60e1dda9015988a453d60358e51f0dbb4292d', deprecated=True) - version('2021.1', sha256='c2fdf5ab72fc75580fb3623182fa88dd0eed856388bdc862aff42148bb0a16e7', deprecated=True) - version('2021', sha256='b84f68ba4a8bfae7b06b61e1e078dcbfb3b340c516da3be39ef545152da00ccd', deprecated=True) - version('1.6.4', sha256='aa79ef4617a80ba3ca063932d5ee0d5767c0285b4b613abd373ad3c986ab9f4c', deprecated=True) - version('1.6.3', sha256='b4ba63861f4342070d81309992f76c4cc798dffeab894bff64799881e75b3cc2', deprecated=True) - version('1.6.2', sha256='1b31e0dd7550b80b963e6714d671f3516d68ebc1e75068a5d827a6e8b4f1759a', deprecated=True) - version('1.6.1', sha256='3e8f51d484cb3fdfbeb851aab387807ba4c40aecef8317c90182da68ad282dcc', deprecated=True) - version('1.6', sha256='cfd0fedc80fecd009f743b5df47777508d76bf3ef294a508a9f11fbb42efe9a5', deprecated=True) - version('1.5.1', sha256='4be4fe25a2910e24e1720cd9022d214001d38196033ade8f9d6e618b4f47d5c4', deprecated=True) - version('1.5', sha256='a82a6596c24ff06e79eab17ca02f4405745ceeeb66369693a59023ad0b62cf22', deprecated=True) - version('1.4.1', sha256='b6b87f6bec8db641a1d8660422ca44919252a69494b32ba6c8c9ac986bae9a65', deprecated=True) - version('1.4', sha256='41638122e7e59852af61d391b4ab8c308fd2e16652f768077e13a99d206ec5d3', deprecated=True) + url = "https://github.com/votca/tools/tarball/v1.4" + git = "https://github.com/votca/tools.git" + maintainers = ["junghans"] + + version("stable", branch="stable", deprecated=True) + version( + "2021.2", + sha256="2cd3175b65924803aff90dce49f60e1dda9015988a453d60358e51f0dbb4292d", + deprecated=True, + ) + version( + "2021.1", + sha256="c2fdf5ab72fc75580fb3623182fa88dd0eed856388bdc862aff42148bb0a16e7", + deprecated=True, + ) + version( + "2021", + sha256="b84f68ba4a8bfae7b06b61e1e078dcbfb3b340c516da3be39ef545152da00ccd", + deprecated=True, + ) + version( + "1.6.4", + sha256="aa79ef4617a80ba3ca063932d5ee0d5767c0285b4b613abd373ad3c986ab9f4c", + deprecated=True, + ) + version( + "1.6.3", + sha256="b4ba63861f4342070d81309992f76c4cc798dffeab894bff64799881e75b3cc2", + deprecated=True, + ) + version( + "1.6.2", + sha256="1b31e0dd7550b80b963e6714d671f3516d68ebc1e75068a5d827a6e8b4f1759a", + deprecated=True, + ) + version( + "1.6.1", + sha256="3e8f51d484cb3fdfbeb851aab387807ba4c40aecef8317c90182da68ad282dcc", + deprecated=True, + ) + version( + "1.6", + sha256="cfd0fedc80fecd009f743b5df47777508d76bf3ef294a508a9f11fbb42efe9a5", + deprecated=True, + ) + version( + "1.5.1", + sha256="4be4fe25a2910e24e1720cd9022d214001d38196033ade8f9d6e618b4f47d5c4", + deprecated=True, + ) + version( + "1.5", + sha256="a82a6596c24ff06e79eab17ca02f4405745ceeeb66369693a59023ad0b62cf22", + deprecated=True, + ) + version( + "1.4.1", + sha256="b6b87f6bec8db641a1d8660422ca44919252a69494b32ba6c8c9ac986bae9a65", + deprecated=True, + ) + version( + "1.4", + sha256="41638122e7e59852af61d391b4ab8c308fd2e16652f768077e13a99d206ec5d3", + deprecated=True, + ) # https://github.com/votca/tools/pull/229, fix mkl in exported target - patch("https://github.com/votca/tools/pull/229.patch?full_index=1", sha256="2a9ef179904d5057f36a5ce533c002d8f5880dc4b3eba569825f4a7e7f055eb1", when="@1.6:1.6.0+mkl") + patch( + "https://github.com/votca/tools/pull/229.patch?full_index=1", + sha256="2a9ef179904d5057f36a5ce533c002d8f5880dc4b3eba569825f4a7e7f055eb1", + when="@1.6:1.6.0+mkl", + ) # https://github.com/votca/tools/pull/361, fix build with newer glibc/gcc, fixed in stable and 2021.1 - patch("https://github.com/votca/tools/commit/6bb7e35ba7d1a31247eafb323be2777ec0439cfe.patch?full_index=1", sha256="5a67eaf362755412b9825558bedb53fac3204713effd60c59f14c54eb1ad52b9", when="@2021:2021.0") + patch( + "https://github.com/votca/tools/commit/6bb7e35ba7d1a31247eafb323be2777ec0439cfe.patch?full_index=1", + sha256="5a67eaf362755412b9825558bedb53fac3204713effd60c59f14c54eb1ad52b9", + when="@2021:2021.0", + ) - variant('mkl', default=False, description='Build with MKL support') - conflicts('+mkl', when='@1.4:1.5') + variant("mkl", default=False, description="Build with MKL support") + conflicts("+mkl", when="@1.4:1.5") - depends_on("cmake@2.8:", type='build') + depends_on("cmake@2.8:", type="build") depends_on("expat") depends_on("fftw-api@3") depends_on("gsl", when="@1.4:1.4.9999") depends_on("eigen@3.3:", when="@stable,1.5:") depends_on("boost+exception+filesystem+system+container+math+program_options") depends_on("sqlite", when="@1.4:1.5") - depends_on('mkl', when='+mkl') + depends_on("mkl", when="+mkl") def cmake_args(self): - args = [ - '-DWITH_RC_FILES=OFF' - ] + args = ["-DWITH_RC_FILES=OFF"] - if '~mkl' in self.spec: - args.append('-DCMAKE_DISABLE_FIND_PACKAGE_MKL=ON') + if "~mkl" in self.spec: + args.append("-DCMAKE_DISABLE_FIND_PACKAGE_MKL=ON") return args |