1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
|
# Copyright 2013-2020 Lawrence Livermore National Security, LLC and other
# Spack Project Developers. See the top-level COPYRIGHT file for details.
#
# SPDX-License-Identifier: (Apache-2.0 OR MIT)
# ----------------------------------------------------------------------------
from spack import *
import os
class GaussianView(Package):
"""GaussView 6 is the latest iteration of a graphical interface used with
Gaussian. It aids in the creation of Gaussian input files, enables the
user to run Gaussian calculations from a graphical interface without the
need for using a command line instruction, and helps in the interpretation
of Gaussian output"""
homepage = "https://gaussian.com/gaussview6/"
manual_download = True
version('6016',
'5dd6a8df8c81763e43a308b3a18d2d3b825d3597e9628dcf43e563d1867b9638',
extension='tbz')
depends_on('gaussian@16-B.01', type='run')
def url_for_version(self, version):
return "file://{0}/gv-{1}-Linux-x86_64.tbz".format(os.getcwd(),
version)
def install(self, spec, prefix):
install_tree(os.getcwd(), self.prefix)
def setup_run_environment(self, env):
env.set('GV_DIR', self.prefix)
env.prepend_path('PATH', self.prefix)
env.set('GV_LIB_PATH', self.prefix.lib)
env.prepend_path('GV_LIB_PATH', self.prefix.lib.MesaGL)
env.prepend_path('LD_LIBRARY_PATH', self.prefix.lib.MesaGL)
env.set('ALLOWINDIRECT', '1')
env.prepend_path('QT_PLUGIN_PATH', self.prefix.plugins)
|