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 (20 years, 4 months ago) by tim
File length: 27123 byte(s)
Diff to previous 1886

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 (20 years, 4 months ago) by tim
File length: 26552 byte(s)
Diff to previous 1856

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 (20 years, 4 months ago) by tim
File length: 26361 byte(s)
Diff to previous 1843

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 (20 years, 5 months ago) by tim
File length: 25613 byte(s)
Diff to previous 1841

Change interface of SimInfo

begin to fix bugs

Revision 1832 - (view) (annotate) - [select for diffs]
Modified Thu Dec 2 16:04:19 2004 UTC (20 years, 5 months ago) by tim
File length: 25660 byte(s)
Diff to previous 1824

still have two linking problem

replace misuse of using namespace std in header files

Revision 1807 - (view) (annotate) - [select for diffs]
Modified Tue Nov 30 22:43:51 2004 UTC (20 years, 5 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 (20 years, 5 months ago) by tim
File length: 24455 byte(s)
Diff to previous 1738

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 (20 years, 5 months ago) by tim
File length: 20892 byte(s)
Diff to previous 1733

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 (20 years, 5 months ago) by tim
File length: 10763 byte(s)
Diff to previous 1726

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 (20 years, 5 months ago) by tim
File length: 8934 byte(s)
Diff to previous 1722

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 (20 years, 5 months ago) by tim
File length: 8479 byte(s)
Diff to previous 1710

Fix Exclude class etc.

adding Stats class

Revision 1701 - (view) (annotate) - [select for diffs]
Modified Wed Nov 3 16:08:43 2004 UTC (20 years, 5 months ago) by tim
File length: 14187 byte(s)
Diff to previous 1683

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 (20 years, 6 months ago) by chrisfen
Original Path: trunk/OOPSE-3.0/src/brains/SimInfo.cpp
File length: 14181 byte(s)
Diff to previous 1617

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 (20 years, 7 months ago) by tim
Original Path: trunk/OOPSE-3.0/src/brains/SimInfo.cpp
File length: 13763 byte(s)
Diff to previous 1490

change the #include in source files

Import of OOPSE v. 2.0