easyconfigs-it4i/m/Molpro/Molpro-mpp-2018.2.0.linux_x86_64_openmp.eb
Lukáš Krupčík 3d9a43d50b new file: a/ANSYS/ANSYS-19.3-intel-2017c.eb
new file:   c/Cargo/Cargo-0.18.0.eb
	new file:   m/Molpro/Molpro-mpp-2018.2.0.linux_x86_64_openmp.eb
	new file:   r/Rust/Rust-1.32.0.eb
	deleted:    m/Molpro/Molpro-mpp-2015.1.10.linux_x86_64_openmp.eb
2019-02-13 15:04:56 +01:00

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# IT4Innovations 2019
name = 'Molpro'
version = '2018.2.0'
versionprefix = 'mpp-'
versionsuffix = '.linux_x86_64_openmp'
homepage = 'https://www.molpro.net'
description = """Molpro is a complete system of ab initio programs for molecular electronic structure calculations."""
toolchain = {'name': 'dummy', 'version': ''}
# no source URL available, requires registration to download
sources = ['%(namelower)s-%(versionprefix)s%(version)s%(versionsuffix)s.sh']
precompiled_binaries = True
# license file - uncomment if a licence file is supplied by your site and
# is valid for all users - the value of license_file may have to be changed
# license_file = HOME + '/licenses/%(name)s/license.lic'
moduleclass = 'chem'