From d154f151aa3a8d79dd19d3c63dc1ea185e72ffc4 Mon Sep 17 00:00:00 2001 From: Denis Davydov Date: Wed, 24 Aug 2016 15:50:58 +0200 Subject: py-cclib: new package --- .../repos/builtin/packages/py-cclib/package.py | 42 ++++++++++++++++++++++ 1 file changed, 42 insertions(+) create mode 100644 var/spack/repos/builtin/packages/py-cclib/package.py (limited to 'var') diff --git a/var/spack/repos/builtin/packages/py-cclib/package.py b/var/spack/repos/builtin/packages/py-cclib/package.py new file mode 100644 index 0000000000..33b1d25c7e --- /dev/null +++ b/var/spack/repos/builtin/packages/py-cclib/package.py @@ -0,0 +1,42 @@ +############################################################################## +# 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 PyCclib(Package): + """Open source library for parsing and interpreting the results of + computational chemistry packages""" + + homepage = "https://cclib.github.io/" + url = "https://github.com/cclib/cclib/releases/download/v1.5/cclib-1.5.tar.gz" + + version('1.5', 'c06940101c4796bce82036b13fecb73c') + + extends('python') + + depends_on('py-numpy@1.5:', type=nolink) + + def install(self, spec, prefix): + setup_py('install', '--prefix={0}'.format(prefix)) -- cgit v1.2.3-70-g09d2