parsplice: initial commit (#5314)

var/spack/repos/builtin/packages/parsplice/package.py

@@ -0,0 +1,48 @@
+##############################################################################
+# Copyright (c) 2017, Los Alamos National Security, LLC
+# Produced at the Los Alamos 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 NOTICE and LICENSE files 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 Parsplice(CMakePackage):
+    """ParSplice code implements the Parallel Trajectory Splicing algorithm"""
+
+    homepage = "https://gitlab.com/exaalt/parsplice"
+    url      = "https://gitlab.com/exaalt/parsplice/tags/v1.0"
+
+    version('develop', git='https://gitlab.com/exaalt/parsplice', branch='master')
+
+    depends_on("cmake@3.1:", type='build')
+    depends_on("berkeley-db")
+    depends_on("nauty")
+    depends_on("boost")
+    depends_on("mpi")
+    depends_on("eigen@3:")
+    depends_on("lammps+lib@20170901:")
+
+    def cmake_args(self):
+        options = ['-DBUILD_SHARED_LIBS=ON']
+
+        return options