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root/group/trunk/OOPSE-4/src/integrators/VelocityVerletIntegrator.hpp
Revision 3520 - (view) (annotate) - [select for diffs]
Modified Mon Sep 7 16:31:51 2009 UTC (15 years ago) by cli2
File length: 3868 byte(s)
Diff to previous 3488
Added new restraint infrastructure
Added MolecularRestraints
Added ObjectRestraints
Added RestraintStamp
Updated thermodynamic integration to use ObjectRestraints
Added Quaternion mathematics for twist swing decompositions
Significantly updated RestWriter and RestReader to use dump-like files
Added selections for x, y, and z coordinates of atoms
Removed monolithic Restraints class
Fixed a few bugs in gradients of Euler angles in DirectionalAtom and RigidBody
Added some rotational capabilities to prinicpalAxisCalculator

Revision 3488 - (view) (annotate) - [select for diffs]
Modified Sat Mar 14 01:23:53 2009 UTC (15 years, 6 months ago) by gezelter
File length: 3921 byte(s)
Diff to previous 2759
Adding RNEMD

Revision 2759 - (view) (annotate) - [select for diffs]
Modified Wed May 17 21:51:42 2006 UTC (18 years, 4 months ago) by tim
File length: 3897 byte(s)
Diff to previous 2243
Adding single precision capabilities to c++ side

Revision 2243 - (view) (annotate) - [select for diffs]
Modified Sun May 29 00:06:14 2005 UTC (19 years, 3 months ago) by tim
File length: 3885 byte(s)
Diff to previous 2204
adding resetIntegrator

Revision 2204 - (view) (annotate) - [select for diffs]
Modified Fri Apr 15 22:04:00 2005 UTC (19 years, 5 months ago) by gezelter
File length: 3820 byte(s)
Diff to previous 2101
xemacs has been drafted to perform our indentation services

Revision 2101 - (view) (annotate) - [select for diffs]
Modified Thu Mar 10 15:10:24 2005 UTC (19 years, 6 months ago) by chrisfen
File length: 3945 byte(s)
Diff to previous 2008
First commit of the new restraints code

Revision 2008 - (view) (annotate) - [select for diffs]
Modified Sun Feb 13 19:10:25 2005 UTC (19 years, 7 months ago) by tim
File length: 3888 byte(s)
Diff to previous 1960
dynamicProps get built

Revision 1960 - (view) (annotate) - [select for diffs]
Modified Wed Jan 26 15:26:47 2005 UTC (19 years, 7 months ago) by tim
File length: 3934 byte(s)
Diff to previous 1930
forget to add eorWriter

Revision 1930 - (view) (annotate) - [select for diffs]
Added Wed Jan 12 22:41:40 2005 UTC (19 years, 8 months ago) by gezelter
File length: 3896 byte(s)
merging new_design branch into OOPSE-2.0

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