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root/group/trunk/mdtools/interface_implementation/SimSetup.cpp
Revision 257 - (view) (annotate) - [select for diffs]
Modified Thu Jan 30 22:29:24 2003 UTC (21 years, 4 months ago) by chuckv
File length: 22965 byte(s)
Diff to previous 254 
MPI is Broooooken. Saving poor state so I know where to begin with.
Revision 254 - (view) (annotate) - [select for diffs]
Modified Thu Jan 30 20:03:37 2003 UTC (21 years, 5 months ago) by chuckv
File length: 23069 byte(s)
Diff to previous 253 
Bug fixes for mpi version of code
Revision 253 - (view) (annotate) - [select for diffs]
Modified Thu Jan 30 15:20:21 2003 UTC (21 years, 5 months ago) by chuckv
File length: 22928 byte(s)
Diff to previous 249 
Added a generic util code directory and moved Linux_ifc_machdep to it.
MPI changes to compile MPI modules.
Revision 249 - (view) (annotate) - [select for diffs]
Modified Mon Jan 27 21:28:19 2003 UTC (21 years, 5 months ago) by chuckv
File length: 22758 byte(s)
Diff to previous 248 
For some unknown reason the Single processor builds. Has not been tested!
Revision 248 - (view) (annotate) - [select for diffs]
Modified Mon Jan 27 19:28:21 2003 UTC (21 years, 5 months ago) by chuckv
File length: 22751 byte(s)
Diff to previous 215 
final version before the single processor build
Revision 215 - (view) (annotate) - [select for diffs]
Modified Thu Dec 19 21:59:51 2002 UTC (21 years, 6 months ago) by chuckv
File length: 22673 byte(s)
Diff to previous 206 
+ added lennard-jones force module and corresponding class.
+ created forceFactory directory.
Revision 206 - (view) (annotate) - [select for diffs]
Modified Thu Dec 12 21:21:59 2002 UTC (21 years, 6 months ago) by chuckv
File length: 22656 byte(s)
Diff to previous 205 
Initial mpi io conversion.
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Modified Wed Dec 11 20:39:41 2002 UTC (21 years, 6 months ago) by mmeineke
File length: 22557 byte(s)
Diff to previous 202 
finished adding in the code to divide and set up the atoms and such across all of the processors.
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Modified Tue Dec 10 21:41:26 2002 UTC (21 years, 6 months ago) by mmeineke
File length: 20969 byte(s)
Diff to previous 198 
*** empty log message ***
Revision 198 - (view) (annotate) - [select for diffs]
Modified Fri Dec 6 21:20:42 2002 UTC (21 years, 6 months ago) by mmeineke
File length: 20263 byte(s)
Diff to previous 195 
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Revision 195 - (view) (annotate) - [select for diffs]
Modified Thu Dec 5 18:53:40 2002 UTC (21 years, 6 months ago) by chuckv
File length: 19251 byte(s)
Diff to previous 194 
Added divideLabor.
Revision 194 - (view) (annotate) - [select for diffs]
Modified Wed Dec 4 21:19:38 2002 UTC (21 years, 6 months ago) by chuckv
File length: 18837 byte(s)
Diff to previous 189 
First addition of mpiDivideLabor to split mpi simulation among processors.
Revision 189 - (view) (annotate) - [select for diffs]
Modified Tue Nov 26 21:04:43 2002 UTC (21 years, 7 months ago) by mmeineke
File length: 18786 byte(s)
Diff to previous 184 
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Revision 184 - (view) (annotate) - [select for diffs]
Modified Thu Nov 21 20:33:06 2002 UTC (21 years, 7 months ago) by mmeineke
File length: 17610 byte(s)
Diff to previous 176 
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Revision 176 - (view) (annotate) - [select for diffs]
Modified Thu Nov 14 22:00:44 2002 UTC (21 years, 7 months ago) by mmeineke
File length: 17588 byte(s)
Diff to previous 164 
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Revision 164 - (view) (annotate) - [select for diffs]
Modified Tue Nov 5 22:04:46 2002 UTC (21 years, 7 months ago) by mmeineke
File length: 17405 byte(s)
Diff to previous 145 
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Revision 145 - (view) (annotate) - [select for diffs]
Modified Fri Oct 18 15:34:21 2002 UTC (21 years, 8 months ago) by mmeineke
File length: 17171 byte(s)
Diff to previous 144 

finished adding the static storage arrays to the atom class
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Modified Thu Oct 17 21:59:12 2002 UTC (21 years, 8 months ago) by mmeineke
File length: 17124 byte(s)
Diff to previous 139 

Changing internal storage of positions, torqes, forces, velocities, etc.

not sure here, still working
Revision 139 - (view) (annotate) - [select for diffs]
Modified Wed Oct 16 21:07:16 2002 UTC (21 years, 8 months ago) by chuckv
File length: 17123 byte(s)
Diff to previous 131 
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Revision 131 - (view) (annotate) - [select for diffs]
Modified Wed Oct 9 22:29:40 2002 UTC (21 years, 8 months ago) by chuckv
File length: 17128 byte(s)
Diff to previous 128 
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Revision 128 - (view) (annotate) - [select for diffs]
Modified Thu Oct 3 21:52:46 2002 UTC (21 years, 8 months ago) by chuckv
File length: 17074 byte(s)
Diff to previous 124 
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Revision 124 - (view) (annotate) - [select for diffs]
Modified Mon Sep 30 20:35:42 2002 UTC (21 years, 9 months ago) by chuckv
File length: 16950 byte(s)
Diff to previous 117 
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Revision 117 - (view) (annotate) - [select for diffs]
Modified Tue Sep 24 22:10:55 2002 UTC (21 years, 9 months ago) by mmeineke
File length: 16693 byte(s)
Diff to previous 113 
fixed allot of warnings, and adde the molecule
Revision 113 - (view) (annotate) - [select for diffs]
Modified Mon Sep 23 15:12:56 2002 UTC (21 years, 9 months ago) by mmeineke
File length: 16511 byte(s)
Diff to previous 11 
starting work on the molecule class

starting to add in the molecule class
Revision 11 - (view) (annotate) - [select for diffs]
Modified Tue Jul 9 18:40:59 2002 UTC (21 years, 11 months ago) by mmeineke
File length: 16415 byte(s)
Copied from: branches/mmeineke/mdtools/interface_implementation/SimSetup.cpp revision 10
Diff to previous 10 
This commit was generated by cvs2svn to compensate for changes in r10, which
included commits to RCS files with non-trunk default branches.
Revision 10 - (view) (annotate) - [select for diffs]
Added Tue Jul 9 18:40:59 2002 UTC (21 years, 11 months ago) by mmeineke
Original Path: branches/mmeineke/mdtools/interface_implementation/SimSetup.cpp
File length: 16415 byte(s) 
everything you need to make libmdtools

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