Revision 1901 - (view) (annotate) - [select for diffs]
Modified Tue Jan 4 22:18:36 2005 UTC (19 years, 6 months ago) by tim
File length: 27134 byte(s)
Diff to previous 1895 , to selected 1807

constraints in progress

Fix a bug in SimInfo which gives the invalid stamp id

Revision 1887 - (view) (annotate) - [select for diffs]
Modified Wed Dec 15 16:44:14 2004 UTC (19 years, 6 months ago) by tim
File length: 27123 byte(s)
Diff to previous 1886 , to selected 1807

fix bugs in getCom and getComVel (forget to call All_reduce in MPI version)

MPI in NVE is working

Revision 1883 - (view) (annotate) - [select for diffs]
Modified Mon Dec 13 22:30:27 2004 UTC (19 years, 6 months ago) by tim
File length: 26552 byte(s)
Diff to previous 1856 , to selected 1807

MPI version is built

fix a bug in Exclude List

Revision 1854 - (view) (annotate) - [select for diffs]
Modified Sun Dec 5 22:02:42 2004 UTC (19 years, 7 months ago) by tim
File length: 26361 byte(s)
Diff to previous 1843 , to selected 1807

fix a bug in filling MolMembership

more missing function get implemented

Revision 1842 - (view) (annotate) - [select for diffs]
Modified Fri Dec 3 20:30:07 2004 UTC (19 years, 7 months ago) by tim
File length: 25613 byte(s)
Diff to previous 1841 , to selected 1807

Change interface of SimInfo

begin to fix bugs

Revision 1832 - (view) (annotate) - [select for diffs]
Modified Thu Dec 2 16:04:19 2004 UTC (19 years, 7 months ago) by tim
File length: 25660 byte(s)
Diff to previous 1824 , to selected 1807

still have two linking problem

replace misuse of using namespace std in header files

Revision 1807 - (view) (annotate) - [selected]
Modified Tue Nov 30 22:43:51 2004 UTC (19 years, 7 months ago) by tim
File length: 25636 byte(s)
Diff to previous 1804

brains get built

fix Thermo

Revision 1739 - (view) (annotate) - [select for diffs]
Modified Mon Nov 15 18:02:15 2004 UTC (19 years, 7 months ago) by tim
File length: 24455 byte(s)
Diff to previous 1738 , to selected 1807

finish DumpReader, DumpWriter.Next Step is LJFF and integrators

refactory, refactory, refactory

Revision 1735 - (view) (annotate) - [select for diffs]
Modified Fri Nov 12 17:40:03 2004 UTC (19 years, 7 months ago) by tim
File length: 20892 byte(s)
Diff to previous 1733 , to selected 1807

SimCreator and SimInfo are  ready for unit test

OOPSE = Object-Obfuscated Parallel Simulation Engine

Revision 1727 - (view) (annotate) - [select for diffs]
Modified Thu Nov 11 16:41:58 2004 UTC (19 years, 7 months ago) by tim
File length: 10763 byte(s)
Diff to previous 1726 , to selected 1807

add Snapshot.cpp, remove useless mpiSimulation

more work on SimInfo

Revision 1725 - (view) (annotate) - [select for diffs]
Modified Wed Nov 10 22:01:06 2004 UTC (19 years, 7 months ago) by tim
File length: 8934 byte(s)
Diff to previous 1722 , to selected 1807

another painful day
(1) SimCreator, SimInfo, mpiSimulation
(2) DumpReader, DumpWriter (InitializeFrom File will be removed)
(3) ForceField (at least LJ) and BondType, BendType, TorsionType
(4)Integrator
(5)oopse.cpp
(6)visitors & Dump2XYZ
(7)SimpleBuilder
(8)Constraint & ZConstraint

adding ForceManager

Revision 1719 - (view) (annotate) - [select for diffs]
Modified Fri Nov 5 23:38:27 2004 UTC (19 years, 8 months ago) by tim
File length: 8479 byte(s)
Diff to previous 1710 , to selected 1807

Fix Exclude class etc.

adding Stats class

Revision 1701 - (view) (annotate) - [select for diffs]
Modified Wed Nov 3 16:08:43 2004 UTC (19 years, 8 months ago) by tim
File length: 14187 byte(s)
Diff to previous 1683 , to selected 1807

mess up ......

This commit was manufactured by cvs2svn to create branch 'new_design'.

Revision 1636 - (view) (annotate) - [select for diffs]
Modified Fri Oct 22 22:54:01 2004 UTC (19 years, 8 months ago) by chrisfen
Original Path: trunk/OOPSE-3.0/src/brains/SimInfo.cpp
File length: 14181 byte(s)
Diff to previous 1617 , to selected 1807

fixey fixey the breakey breakey

Fortran/C++ interface de-obfuscation project (It is a very long story)

Revision 1492 - (view) (annotate) - [select for diffs]
Modified Fri Sep 24 16:27:58 2004 UTC (19 years, 9 months ago) by tim
Original Path: trunk/OOPSE-3.0/src/brains/SimInfo.cpp
File length: 13763 byte(s)
Diff to previous 1490 , to selected 1807

change the #include in source files

Import of OOPSE v. 2.0