[ViewVC] Log of: OpenMD/branches/development/src/integrators/VelocityVerletIntegrator.hpp

Revision 1808 - (view) (annotate) - [select for diffs]
Modified Mon Oct 22 20:42:10 2012 UTC (12 years, 6 months ago) by gezelter
File length: 3759 byte(s)
Diff to previous 1731

A bug fix in the electric field for the new electrostatic code.  Also comment fixes for Doxygen

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Modified Thu May 31 12:25:30 2012 UTC (12 years, 11 months ago) by gezelter
File length: 3776 byte(s)
Diff to previous 1715

Reorganized source directories, added RNEMD and flucQ blocks for
options parsing.

Revision 1715 - (view) (annotate) - [select for diffs]
Modified Tue May 22 21:55:31 2012 UTC (12 years, 11 months ago) by gezelter
File length: 3782 byte(s)
Diff to previous 1665

Adding more support structure for Fluctuating Charges.

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Modified Tue Nov 22 20:38:56 2011 UTC (13 years, 5 months ago) by gezelter
File length: 4006 byte(s)
Diff to previous 1465

updated copyright notices

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Modified Fri Jul 9 23:08:25 2010 UTC (14 years, 9 months ago) by chuckv
File length: 3940 byte(s)
Diff to previous 1464

Creating busticated version of OpenMD

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Modified Fri Jul 9 19:29:05 2010 UTC (14 years, 9 months ago) by gezelter
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3940 byte(s)
Diff to previous 1442

removing cruft (atom numbers, do_pot, do_stress) from many modules and
force managers

Revision 1442 - (view) (annotate) - [select for diffs]
Modified Mon May 10 17:28:26 2010 UTC (14 years, 11 months ago) by gezelter
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3975 byte(s)
Diff to previous 1413

Adding property set to svn entries

Revision 1413 - (view) (annotate) - [select for diffs]
Modified Mon Mar 22 19:21:22 2010 UTC (15 years, 1 month ago) by gezelter
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3975 byte(s)
Diff to previous 1390

Adding a progress bar, and pAngle staticProps

Revision 1390 - (view) (annotate) - [select for diffs]
Modified Wed Nov 25 20:02:06 2009 UTC (15 years, 5 months ago) by gezelter
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3911 byte(s)
Diff to previous 1360

Almost all of the changes necessary to create OpenMD out of our old
project (OOPSE-4)

Revision 1360 - (view) (annotate) - [select for diffs]
Modified Mon Sep 7 16:31:51 2009 UTC (15 years, 7 months ago) by cli2
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3868 byte(s)
Diff to previous 1329

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 1329 - (view) (annotate) - [select for diffs]
Modified Sat Mar 14 01:23:53 2009 UTC (16 years, 1 month ago) by gezelter
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3921 byte(s)
Diff to previous 963

Adding RNEMD

Revision 963 - (view) (annotate) - [select for diffs]
Modified Wed May 17 21:51:42 2006 UTC (18 years, 11 months ago) by tim
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3897 byte(s)
Diff to previous 546

Adding single precision capabilities to c++ side

Revision 546 - (view) (annotate) - [select for diffs]
Modified Sun May 29 00:06:14 2005 UTC (19 years, 11 months ago) by tim
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3885 byte(s)
Diff to previous 507

adding resetIntegrator

Revision 507 - (view) (annotate) - [select for diffs]
Modified Fri Apr 15 22:04:00 2005 UTC (20 years ago) by gezelter
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3820 byte(s)
Diff to previous 417

xemacs has been drafted to perform our indentation services

Revision 417 - (view) (annotate) - [select for diffs]
Modified Thu Mar 10 15:10:24 2005 UTC (20 years, 1 month ago) by chrisfen
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3945 byte(s)
Diff to previous 324

First commit of the new restraints code

Revision 324 - (view) (annotate) - [select for diffs]
Modified Sun Feb 13 19:10:25 2005 UTC (20 years, 2 months ago) by tim
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3888 byte(s)
Diff to previous 276

dynamicProps get built

Revision 276 - (view) (annotate) - [select for diffs]
Modified Wed Jan 26 15:26:47 2005 UTC (20 years, 3 months ago) by tim
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3934 byte(s)
Diff to previous 246

forget to add eorWriter

Revision 246 - (view) (annotate) - [select for diffs]
Added Wed Jan 12 22:41:40 2005 UTC (20 years, 3 months ago) by gezelter
Original Path: trunk/src/integrators/VelocityVerletIntegrator.hpp
File length: 3896 byte(s)

merging new_design branch into OOPSE-2.0

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