Revision 1674 - (view) (annotate) - [select for diffs]
Modified Thu Feb 16 15:59:20 2012 UTC (13 years, 2 months ago) by gezelter
File length: 13701 byte(s)
Diff to previous 1668

Fixed two bugs in new Gay-Berne module.  Torque 2 had a sign error, and there
was a subtle mixing bug for dissimilar particles in different orderings.

Some fixes for CMake and single precision builds

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: 14069 byte(s)
Diff to previous 1587

updated copyright notices

Fixes

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: 13114 byte(s)
Diff to previous 1571

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

Added Atypes to new C++ force decomposition.

Revision 1554 - (view) (annotate) - [select for diffs]
Modified Sat Apr 30 02:54:02 2011 UTC (14 years ago) by gezelter
File length: 13114 byte(s)
Diff to previous 1549

For efficiency, pointers instead of objects will be passed during main
force loop. 

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

Revision 1545 - (view) (annotate) - [select for diffs]
Modified Fri Apr 8 21:25:19 2011 UTC (14 years ago) by gezelter
File length: 12950 byte(s)
Diff to previous 1536

still busted, but much progress

compiles, builds and runs, but is very slow

Revision 1505 - (view) (annotate) - [select for diffs]
Modified Sun Oct 3 22:18:59 2010 UTC (14 years, 7 months ago) by gezelter
File length: 12915 byte(s)
Diff to previous 1502

Less busted than it was on last check-in, but still won't completely
build.

Many changes, and we're not quite done with this phase yet.

Revision 1485 - (view) (annotate) - [select for diffs]
Modified Wed Jul 28 19:52:00 2010 UTC (14 years, 9 months ago) by gezelter
File length: 13724 byte(s)
Diff to previous 1483

Converting Sticky over to C++

Added GB module to the C++ side, got rid of it on the fortran side.