comp-chem/NWChem
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NWChem/examples/md
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Tjerk Straatsma d354e90d8f Minor fix in bnz.frg
2004-12-08 23:26:50 +00:00
..
ache Updated 2004-12-07 21:53:36 +00:00
benzene Minor fix in bnz.frg 2004-12-08 23:26:50 +00:00
crown Include keyword 'free' 2004-12-07 23:22:03 +00:00
dna Fix terminal NA names 2004-12-07 23:43:00 +00:00
edta Example jobs 2001-05-01 01:51:55 +00:00
hrc Example jobs 2001-05-01 01:51:55 +00:00
membrane Add example of setting up a membrane simulation 2001-11-26 21:13:42 +00:00
myo Example jobs 2001-05-01 01:51:55 +00:00
nak Add keyword 'free' 2004-12-08 20:16:13 +00:00
octane Example jobs 2001-05-01 01:51:55 +00:00
octanol Example jobs 2001-05-01 01:51:55 +00:00
sdm Example jobs 2001-05-01 01:51:55 +00:00
water Example jobs 2001-05-01 01:51:55 +00:00