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42 lines
1.4 KiB
Plaintext
42 lines
1.4 KiB
Plaintext
# IT4Innovations 2019
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name = 'OpenBabel'
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version = '2.4.1'
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versionsuffix = '-Python-%(pyver)s'
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homepage = 'http://openbabel.org'
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description = """Open Babel is a chemical toolbox designed to speak the many
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languages of chemical data. It's an open, collaborative project allowing anyone
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to search, convert, analyze, or store data from molecular modeling, chemistry,
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solid-state materials, biochemistry, or related areas."""
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toolchain = {'name': 'GCCcore', 'version': '6.3.0'}
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toolchainopts = {'optarch': True}
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source_urls = [SOURCEFORGE_SOURCE]
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sources = [SOURCELOWER_TAR_GZ]
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patches = [
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'OpenBabel-2.3.2-use-xHost.patch',
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'OpenBabel-%(version)s-fix-link-path-tests.patch',
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'OpenBabel-%(version)s_fix-Python-3.patch',
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]
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checksums = [
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'204136582cdfe51d792000b20202de8950218d617fd9c6e18cee36706a376dfc', # openbabel-2.4.1.tar.gz
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'0db85c64f53862dce05ada9091a35d7b4c5c29a44aef76e0cb41cd679441a446', # OpenBabel-2.3.2-use-xHost.patch
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'a6a1f687fc22e20a83b4f8c5e89e32e3eebefb1bb9440c9ca3848d23120bc458', # OpenBabel-2.4.1-fix-link-path-tests.patch
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'270ab3770839b4163c906ed88366157d8823b7038863d1b3affec04cd0b788bf', # OpenBabel-2.4.1_fix-Python-3.patch
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]
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builddependencies = [('CMake', '3.14.1', '', True)]
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dependencies = [
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('Python', '3.7.3'),
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('zlib', '1.2.11', '', True),
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('libxml2', '2.9.9', '', True),
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('Eigen', '3.3.7', '', True),
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]
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runtest = 'test'
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moduleclass = 'chem'
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