Revision
2097 -
Directory Listing
-
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Modified
Wed Mar 9 17:30:29 2005 UTC
(19 years, 5 months ago)
by
tim
Diff to
previous 2094
adding IndexFinder which is used to select the molecules; Seperate ElectrostaticAtomTypesSectionParser into
ChargeAtomTypesSectionParser and MultipoleAtomTypesSectionParser;remove print dipole option from Dump2XYZ;
Revision
2094 -
Directory Listing
-
[selected]
Modified
Wed Mar 9 14:26:15 2005 UTC
(19 years, 5 months ago)
by
gezelter
Diff to
previous 2089
added splitDipole and fixed quadrupole stuff
Revision
1957 -
Directory Listing
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[select for diffs]
Modified
Tue Jan 25 17:45:23 2005 UTC
(19 years, 7 months ago)
by
tim
Diff to
previous 1951
,
to
selected 2094
(1) complete section parser's error message
(2) add GhostTorsion
(3) accumulate inertial tensor from the directional atoms before calculate rigidbody's inertial tensor