Revision 1198 - (view) (annotate) - [select for diffs]
Modified Thu May 27 00:48:12 2004 UTC (20 years, 11 months ago) by tim
File length: 8818 byte(s)
Diff to previous 1129 , to selected 441

in the progress of fixing MPI version of cutoff group

fixed two bugs in MPI version of InitfromFile and one unmatch MPI command in DumpWriter

Revision 1108 - (view) (annotate) - [select for diffs]
Modified Wed Apr 14 15:37:41 2004 UTC (21 years ago) by tim
File length: 8687 byte(s)
Diff to previous 989 , to selected 441

Change DumpWriter and InitFromFile

More BASS changes to do new rigidBody scheme
a copy of WATER.cpp from this morning

Revision 958 - (view) (annotate) - [select for diffs]
Modified Mon Jan 19 16:09:52 2004 UTC (21 years, 3 months ago) by gezelter
File length: 8336 byte(s)
Diff to previous 829 , to selected 441

BASS changes to add RigidBodies required a change in
how the MoleculeStamps are used by divideLabor in mpiSimulation.cpp

replace c++ header stuff with more portable c header stuff
Also, mod file fixes and portability changes
Some fortran changes will need to be reversed.

Revision 787 - (view) (annotate) - [select for diffs]
Modified Thu Sep 25 19:27:15 2003 UTC (21 years, 7 months ago) by mmeineke
File length: 8331 byte(s)
Diff to previous 726 , to selected 441

cleaned things with gcc -Wall and g++ -Wall

set default force substraction policy to PolicyByMass

Revision 708 - (view) (annotate) - [select for diffs]
Modified Wed Aug 20 22:23:34 2003 UTC (21 years, 8 months ago) by tim
File length: 8455 byte(s)
Diff to previous 447 , to selected 441

user can setup seed in bass file now, if he does not specify any value for
seed, oopse will take the value of seconds of system time as seed

fixed some small things with simError.h

Revision 441 - (view) (annotate) - [selected]
Modified Tue Apr 1 16:50:14 2003 UTC (22 years, 1 month ago) by chuckv
File length: 8560 byte(s)
Diff to previous 434

more bug fixes....

mpi fixes and debugging mpi read write from file.

Revision 432 - (view) (annotate) - [select for diffs]
Modified Thu Mar 27 23:33:40 2003 UTC (22 years, 1 month ago) by chuckv
File length: 8714 byte(s)
Diff to previous 422 , to selected 441

MPI buggy, fixed mpiRefresh issue.

finished updating SimSetup to initialize and use the new MPI division of labour, and Molecule class

Revision 419 - (view) (annotate) - [select for diffs]
Modified Thu Mar 27 15:07:29 2003 UTC (22 years, 1 month ago) by gezelter
File length: 8648 byte(s)
Diff to previous 418 , to selected 441

fixes for local->global atom numbering in MPI

little bug fixes here and there.

Revision 416 - (view) (annotate) - [select for diffs]
Modified Wed Mar 26 23:14:02 2003 UTC (22 years, 1 month ago) by gezelter
File length: 8576 byte(s)
Diff to previous 406 , to selected 441

bug fixes   many bug fixes

Finished globalIndex.

Revision 405 - (view) (annotate) - [select for diffs]
Modified Wed Mar 26 18:02:18 2003 UTC (22 years, 1 month ago) by gezelter
File length: 8503 byte(s)
Diff to previous 404 , to selected 441

MPI stuff for passing out molecules

working on load balancing

Revision 378 - (view) (annotate) - [select for diffs]
Modified Fri Mar 21 17:42:12 2003 UTC (22 years, 1 month ago) by mmeineke
File length: 4823 byte(s)
Copied from: branches/mmeineke/OOPSE/libmdtools/mpiSimulation.cpp revision 377
Diff to previous 377 , to selected 441

This commit was generated by cvs2svn to compensate for changes in r377,
which included commits to RCS files with non-trunk default branches.

New OOPSE Tree