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23 lines
791 B
Plaintext
23 lines
791 B
Plaintext
name = 'ADF'
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version = '2014.11.r48287'
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homepage = 'http://www.scm.com/ADF/'
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description = """ADF is an accurate, parallelized, powerful local_computational chemistry program to understand and
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predict chemical structure and reactivity with density functional theory (DFT)."""
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toolchain = {'name': 'intel', 'version': '2016a'}
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sources = [
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'%(namelower)s%(version)s.src.tgz',
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# no exact match on revision ID available, but not strictly needed
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'fix2014.pc64_linux.intelmpi.r48660.2.555.bin.tgz',
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]
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license_file = HOME + "/licenses/ADF/license.txt"
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modloadmsg = "These environment variables need to be defined before using ADF:\n"
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modloadmsg += " * $SCMLICENSE: path to ADF license file\n"
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modloadmsg += " * $SCM_TMPDIR: path to user scratch directory"
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moduleclass = 'chem'
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