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32 lines
740 B
Plaintext
32 lines
740 B
Plaintext
# IT4Innovations
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easyblock = 'MakeCp'
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name = 'Molden'
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version = '5.7'
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homepage = 'http://www.cmbi.ru.nl/molden/'
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description = """Molden is a package for displaying Molecular Density from the
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Ab Initio packages GAMESS-UK, GAMESS-US and GAUSSIAN and the Semi-Empirical
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packages Mopac/Ampac"""
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toolchain = {'name': 'intel', 'version': '2017b'}
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sources = ['%(namelower)s%(version)s.tar.gz']
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source_urls = ['http://ftp.cmbi.ru.nl/pub/molgraph/molden']
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dependencies = [
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('X11', '20160819', '', True),
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]
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buildopts = 'CC="$CC" FC="$F90" molden'
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files_to_copy = [(['molden'], 'bin'), 'CopyRight', 'README', 'REGISTER']
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sanity_check_paths = {
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'files': ['bin/molden', 'README', 'REGISTER'],
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'dirs': [],
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}
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moduleclass = 'chem'
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