c5883fffd7
This PR removes [end of life](https://endoflife.date/python) versions of Python from Spack. Specifically, this includes all versions of Python older than 3.7. See https://github.com/spack/spack/discussions/31824 for rationale. Deprecated in #32615. And #28003. For anyone using software that relies on Python 2, you have a few options: * Upgrade the software to support Python 3. The `3to2` tool may get you most of the way there, although more complex libraries may need manual tweaking. * Add Python 2 as an [external package](https://spack.readthedocs.io/en/latest/build_settings.html#external-packages). Many Python libraries do not support Python 2, but you may be able to add older versions that did once upon a time. * Use Spack 0.19. Spack 0.19 is the last release to officially support Python 3.6 and older * Create and maintain your own [custom repository](https://spack.readthedocs.io/en/latest/repositories.html). Basically, you would need a package for Python 2 and any other Python 2-specific libraries you need.
81 lines
2.9 KiB
Python
81 lines
2.9 KiB
Python
# Copyright 2013-2021 Lawrence Livermore National Security, LLC and other
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# Spack Project Developers. See the top-level COPYRIGHT file for details.
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#
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# SPDX-License-Identifier: (Apache-2.0 OR MIT)
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from spack.package import *
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class BigdftAtlab(AutotoolsPackage):
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"""BigDFT-atlab: library for ATomic related operations."""
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homepage = "https://bigdft.org/"
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url = "https://gitlab.com/l_sim/bigdft-suite/-/archive/1.9.2/bigdft-suite-1.9.2.tar.gz"
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git = "https://gitlab.com/l_sim/bigdft-suite.git"
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version("develop", branch="devel")
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version("1.9.2", sha256="dc9e49b68f122a9886fa0ef09970f62e7ba21bb9ab1b86be9b7d7e22ed8fbe0f")
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version("1.9.1", sha256="3c334da26d2a201b572579fc1a7f8caad1cbf971e848a3e10d83bc4dc8c82e41")
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version("1.9.0", sha256="4500e505f5a29d213f678a91d00a10fef9dc00860ea4b3edf9280f33ed0d1ac8")
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variant("mpi", default=True, description="Enable MPI support")
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variant("openmp", default=True, description="Enable OpenMP support")
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variant("openbabel", default=False, description="Enable detection of openbabel compilation")
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depends_on("mpi", when="+mpi")
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depends_on("openbabel", when="+openbabel")
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for vers in ["1.9.0", "1.9.1", "1.9.2", "develop"]:
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depends_on("bigdft-futile@{0}".format(vers), when="@{0}".format(vers))
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build_directory = "atlab"
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def autoreconf(self, spec, prefix):
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autoreconf = which("autoreconf")
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with working_dir(self.build_directory):
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autoreconf("-fi")
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def configure_args(self):
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spec = self.spec
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prefix = self.prefix
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openmp_flag = []
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if "+openmp" in spec:
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openmp_flag.append(self.compiler.openmp_flag)
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args = [
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"FCFLAGS=%s" % " ".join(openmp_flag),
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"--with-futile-libs=%s" % spec["bigdft-futile"].prefix.lib,
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"--with-futile-incs=%s" % spec["bigdft-futile"].prefix.include,
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"--with-moduledir=%s" % prefix.include,
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"--prefix=%s" % prefix,
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"--without-etsf-io",
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]
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if "+mpi" in spec:
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args.append("CC=%s" % spec["mpi"].mpicc)
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args.append("CXX=%s" % spec["mpi"].mpicxx)
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args.append("FC=%s" % spec["mpi"].mpifc)
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args.append("F90=%s" % spec["mpi"].mpifc)
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args.append("F77=%s" % spec["mpi"].mpif77)
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else:
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args.append("--disable-mpi")
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if "+openmp" in spec:
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args.append("--with-openmp")
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else:
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args.append("--without-openmp")
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if "+openbabel" in spec:
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args.append("--enable-openbabel")
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args.append("--with-openbabel-libs=%s" % spec["openbabel"].prefix.lib)
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args.append("--with-openbabel-incs=%s" % spec["openbabel"].prefix.include)
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return args
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@property
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def libs(self):
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shared = "+shared" in self.spec
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return find_libraries("libatlab-*", root=self.prefix, shared=shared, recursive=True)
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