Revision
3129 -
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Modified
Fri Apr 20 18:15:48 2007 UTC
(17 years, 4 months ago)
by
chrisfen
Diff to
previous 2787
SF Lennard-Jones was added for everyones' enjoyment. The behavior is tethered to the electrostaticSummationMethod keyword.
Revision
2787 -
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Modified
Mon Jun 5 18:24:45 2006 UTC
(18 years, 3 months ago)
by
gezelter
Diff to
previous 2759
Massive changes for GB code with multiple ellipsoid types (a la
Cleaver's paper).
Also, changes in hydrodynamics code to make HydroProp a somewhat
smarter class (rather than just a struct).
Revision
2515 -
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Modified
Fri Dec 16 18:26:41 2005 UTC
(18 years, 8 months ago)
by
tim
Diff to
previous 2507
the standard library came with SUN compiler does not have a conforming std::use_facet, define a macro
to handle it. Adding exception handling to SimCreator.
Revision
2211 -
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Modified
Thu Apr 21 14:12:19 2005 UTC
(19 years, 4 months ago)
by
chrisfen
Diff to
previous 2204
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
Revision
2097 -
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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
1957 -
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Modified
Tue Jan 25 17:45:23 2005 UTC
(19 years, 7 months ago)
by
tim
Diff to
previous 1951
(1) complete section parser's error message
(2) add GhostTorsion
(3) accumulate inertial tensor from the directional atoms before calculate rigidbody's inertial tensor