Revision 1856 - (view) (annotate) - [select for diffs]
Modified Tue Apr 2 21:30:34 2013 UTC (12 years ago) by gezelter
File length: 8171 byte(s)
Diff to previous 1850

Bug fixes to get new parallel decomposition methods working without periodic boundary conditions.  
Updated volume in stats file correctly.
LangevinHull fixes for low viscosity values.

Fixed a widespread typo in the license 

Revision 1761 - (view) (annotate) - [select for diffs]
Modified Fri Jun 22 20:01:37 2012 UTC (12 years, 10 months ago) by gezelter
File length: 8129 byte(s)
Diff to previous 1760

fixes for fluctuating charges

Some bugfixes (CholeskyDecomposition), more work on fluctuating charges,
migrating stats stuff into frameData

Revision 1756 - (view) (annotate) - [select for diffs]
Modified Mon Jun 18 18:23:20 2012 UTC (12 years, 10 months ago) by gezelter
File length: 7818 byte(s)
Diff to previous 1723

bugfixes for self interactions (particularly in parallel)

Bug fixes for heat flux import

Revision 1665 - (view) (annotate) - [select for diffs]
Modified Tue Nov 22 20:38:56 2011 UTC (13 years, 5 months ago) by gezelter
File length: 7527 byte(s)
Diff to previous 1591

updated copyright notices

Efficiency fix

Revision 1587 - (view) (annotate) - [select for diffs]
Modified Fri Jul 8 20:25:32 2011 UTC (13 years, 9 months ago) by gezelter
File length: 7426 byte(s)
Diff to previous 1583

Fixes

Bug squashing

Revision 1582 - (view) (annotate) - [select for diffs]
Modified Tue Jun 14 20:41:44 2011 UTC (13 years, 10 months ago) by gezelter
File length: 7321 byte(s)
Diff to previous 1581

Well, the potential energy values are still garbage, but the LJ sample
runs.

bug fixes

Revision 1579 - (view) (annotate) - [select for diffs]
Modified Thu Jun 9 20:26:29 2011 UTC (13 years, 10 months ago) by gezelter
File length: 7252 byte(s)
Diff to previous 1576

bug fixes (not done yet)

migrating cutoff information from InteractionManager to ForceManager

Revision 1575 - (view) (annotate) - [select for diffs]
Modified Fri Jun 3 21:39:49 2011 UTC (13 years, 10 months ago) by gezelter
File length: 7373 byte(s)
Diff to previous 1571

more parallel fixes

Added Atypes to new C++ force decomposition.

Revision 1570 - (view) (annotate) - [select for diffs]
Modified Thu May 26 21:56:04 2011 UTC (13 years, 11 months ago) by gezelter
File length: 7130 byte(s)
Diff to previous 1569

More fixes

A few more fixes for the missing routines

Revision 1568 - (view) (annotate) - [select for diffs]
Modified Wed May 25 16:20:37 2011 UTC (13 years, 11 months ago) by gezelter
File length: 7082 byte(s)
Diff to previous 1562

Added neighbor list check, and migrated skinThickness into
ForceDecomposition (and out of the InteractionManager).  Removed a
spurious inline.

changes for cell linked lists

Revision 1549 - (view) (annotate) - [select for diffs]
Modified Wed Apr 27 18:38:15 2011 UTC (14 years ago) by gezelter
File length: 6775 byte(s)
Copied from: branches/development/src/parallel/Decomposition.hpp revision 1547
Diff to previous 1546

a few more tweaks   We're getting somewhat closer to deleting fortran.

closer to a real force loop

Revision 1545 - (view) (annotate) - [select for diffs]
Modified Fri Apr 8 21:25:19 2011 UTC (14 years ago) by gezelter
Original Path: branches/development/src/parallel/Decomposition.hpp
File length: 6696 byte(s)
Diff to previous 1544

still busted, but much progress

More modifications for paralllel rewrite

Revision 1539 - (view) (annotate) - [select for diffs]
Added Fri Jan 14 22:31:31 2011 UTC (14 years, 3 months ago) by gezelter
Original Path: branches/development/src/parallel/Decomposition.hpp
File length: 4319 byte(s)

Starting a Parallel architecture