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a9d0110498
new file: s/sqsgenerator/sqsgenerator-20180823-Py-3.6.patch Former-commit-id: 7666d0df749e55b212cdef833462ade7a5f13101
31 lines
1020 B
Plaintext
31 lines
1020 B
Plaintext
# IT4Innovations 2018
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easyblock = 'PythonPackage'
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name = 'sqsgenerator'
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version = '20180823'
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homepage = 'https://github.com/dnoeger/sqsgenerator'
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description = """This package is a Special Quasirandom Structure generator written in Python3/Cython.
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Please note that the programm currently only works with Python 3."""
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toolchain = {'name': 'Py', 'version': '3.6'}
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source_urls = ['https://github.com/dnoeger/sqsgenerator/archive/']
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sources = ['1da686b94d5bcc9bf3e6c4983823efe86c5b2dd7.zip']
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patches = ['sqsgenerator-20180823-Py-3.6.patch']
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dependencies = [
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('Cython', '0.27.3'),
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('pymatgen', '2018.1.29'),
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('GMP', '6.1.2', '', True),
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]
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sanity_check_paths = {
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'files': ['bin/chardetect', 'bin/cygdb', 'bin/cython', 'bin/cythonize', 'bin/f2py', 'bin/feff_input_generation', 'bin/feff_plot_cross_section', 'bin/feff_plot_dos', 'bin/gaussian_analyzer', 'bin/get_environment', 'bin/isympy', 'bin/pmg', 'bin/pydii', 'bin/sqsgenerator', 'bin/tabulate'],
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'dirs': ['bin', 'lib']
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}
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moduleclass = 'lang'
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