diff options
Diffstat (limited to 'var')
| -rw-r--r-- | var/spack/repos/builtin/packages/intelmpi/package.py | 31 | ||||
| -rw-r--r-- | var/spack/repos/builtin/packages/plumed/package.py | 61 |
2 files changed, 72 insertions, 20 deletions
diff --git a/var/spack/repos/builtin/packages/intelmpi/package.py b/var/spack/repos/builtin/packages/intelmpi/package.py index 7fec2a5832..6750ee695a 100644 --- a/var/spack/repos/builtin/packages/intelmpi/package.py +++ b/var/spack/repos/builtin/packages/intelmpi/package.py @@ -1,3 +1,27 @@ +############################################################################## +# Copyright (c) 2013-2016, Lawrence Livermore National Security, LLC. +# Produced at the Lawrence Livermore National Laboratory. +# +# This file is part of Spack. +# Created by Todd Gamblin, tgamblin@llnl.gov, All rights reserved. +# LLNL-CODE-647188 +# +# For details, see https://github.com/llnl/spack +# Please also see the LICENSE file for our notice and the LGPL. +# +# This program is free software; you can redistribute it and/or modify +# it under the terms of the GNU Lesser General Public License (as +# published by the Free Software Foundation) version 2.1, February 1999. +# +# This program is distributed in the hope that it will be useful, but +# WITHOUT ANY WARRANTY; without even the IMPLIED WARRANTY OF +# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the terms and +# conditions of the GNU Lesser General Public License for more details. +# +# You should have received a copy of the GNU Lesser General Public +# License along with this program; if not, write to the Free Software +# Foundation, Inc., 59 Temple Place, Suite 330, Boston, MA 02111-1307 USA +############################################################################## from spack import * class Intelmpi(Package): @@ -17,6 +41,13 @@ class Intelmpi(Package): spack_env.set('MPIF77', join_path(self.prefix.bin, 'mpif77')) spack_env.set('MPIF90', join_path(self.prefix.bin, 'mpif90')) + def setup_dependent_package(self, module, dep_spec): + self.spec.mpicc = join_path(self.prefix.bin, 'mpicc') + self.spec.mpicxx = join_path(self.prefix.bin, 'mpic++') + self.spec.mpifc = join_path(self.prefix.bin, 'mpif90') + self.spec.mpif77 = join_path(self.prefix.bin, 'mpif77') + self.spec.cppflags = '-DMPICH_IGNORE_CXX_SEEK' + # def install(self, spec, prefix): # configure("--prefix=%s" % prefix) # make() diff --git a/var/spack/repos/builtin/packages/plumed/package.py b/var/spack/repos/builtin/packages/plumed/package.py index 58b3ba17c4..023de82b9b 100644 --- a/var/spack/repos/builtin/packages/plumed/package.py +++ b/var/spack/repos/builtin/packages/plumed/package.py @@ -22,21 +22,6 @@ # License along with this program; if not, write to the Free Software # Foundation, Inc., 59 Temple Place, Suite 330, Boston, MA 02111-1307 USA ############################################################################## -# -# This is a template package file for Spack. We've put "FIXME" -# next to all the things you'll want to change. Once you've handled -# them, you can save this file and test your package like this: -# -# spack install plumed -# -# You can edit this file again by typing: -# -# spack edit plumed -# -# See the Spack documentation for more information on packaging. -# If you submit this package back to Spack as a pull request, -# please first remove this boilerplate and all FIXME comments. -# from spack import * @@ -51,11 +36,47 @@ class Plumed(Package): version('2.2.3', git="https://github.com/plumed/plumed2.git", tag='v2.2.3') - # FIXME: Add additional dependencies if required. - depends_on('mpi') + # Variants + variant('crystallization', default=False, + description='Build support for optional crystallization module.') + variant('imd', default=False, + description='Build support for optional imd module.') + variant('manyrestraints', default=False, + description='Build support for optional manyrestraints module.') + variant('mpi', default=False, + description='Enable MPI support.') + + # Dependencies + depends_on("mpi", when="+mpi") + depends_on("netlib-lapack") + depends_on("openblas") def install(self, spec, prefix): - configure("--prefix=" + prefix, - "--enable-mpi", - "-enable-modules=crystallization") + configure("--prefix=" + prefix) +# "--enable-mpi", +# "-enable-modules=crystallization") + + # Construct list of optional modules + module_opts=[] + module_opts.extend([ + '+crystallization' if '+crystallization' in spec else '-crystallization', + '+imd' if '+imd' in spec else '-imd', + '+manyrestraints' if '+manyrestraints' in spec else '-manyrestraints' + ]) + + # Add optional arguments based on specs and variants +# config_args.extend([ + # Modules +# "--enable-modules=%s" % "".join(module_opts) if module_opts is not None, +# "--enable-mpi" if '+mpi' in spec +# ]) + + if modules_opts: + config_args.extend(["--enable-modules=%s" % "".join(module_opts)]) + + config_args.extend([ + "--enable-mpi" if '+mpi' in spec else "--disable-mpi" + ]) + make() + make("install") |