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root/group/trunk/mdtools/interface_implementation/LJ_FF.cpp
Revision 263 - (view) (annotate) - [select for diffs]
Modified Tue Feb 4 20:15:48 2003 UTC (21 years, 4 months ago) by chuckv
File length: 15216 byte(s)
Diff to previous 257 
Changed to single version.
No change.
Revision 257 - (view) (annotate) - [select for diffs]
Modified Thu Jan 30 22:29:24 2003 UTC (21 years, 5 months ago) by chuckv
File length: 15214 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: 14989 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: 14991 byte(s)
Diff to previous 252 
Added a generic util code directory and moved Linux_ifc_machdep to it.
MPI changes to compile MPI modules.
Revision 252 - (view) (annotate) - [select for diffs]
Modified Tue Jan 28 22:16:55 2003 UTC (21 years, 5 months ago) by chuckv
File length: 14852 byte(s)
Diff to previous 249 
Force loops seems to work, velocitize never being called....
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: 14848 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: 14824 byte(s)
Diff to previous 240 
final version before the single processor build
Revision 240 - (view) (annotate) - [select for diffs]
Modified Wed Jan 22 21:45:20 2003 UTC (21 years, 5 months ago) by chuckv
File length: 14156 byte(s)
Diff to previous 238 
Added init function to c++ force module.
Revision 238 - (view) (annotate) - [select for diffs]
Modified Fri Jan 17 21:53:36 2003 UTC (21 years, 5 months ago) by mmeineke
File length: 13374 byte(s)
Diff to previous 236 
*** empty log message ***
Revision 236 - (view) (annotate) - [select for diffs]
Modified Mon Jan 13 22:06:21 2003 UTC (21 years, 5 months ago) by mmeineke
File length: 12279 byte(s)
Diff to previous 234 
this  completes the addition of fvortran function wrapping into the LJ_FF class.
Revision 234 - (view) (annotate) - [select for diffs]
Modified Fri Jan 10 21:56:06 2003 UTC (21 years, 5 months ago) by mmeineke
File length: 10462 byte(s)
Diff to previous 230 
started some additions to wrap LJ down to fortran. INCOMPLETE!
Revision 230 - (view) (annotate) - [select for diffs]
Modified Thu Jan 9 19:40:38 2003 UTC (21 years, 5 months ago) by chuckv
File length: 10285 byte(s)
Diff to previous 224 
More changes to lj_FF.
Revision 224 - (view) (annotate) - [select for diffs]
Modified Wed Jan 8 21:53:53 2003 UTC (21 years, 5 months ago) by mmeineke
File length: 10253 byte(s)
Diff to previous 215 
fixed up the LJ_FF implementation. It is now the standard for building a force routine.
Revision 215 - (view) (annotate) - [select for diffs]
Added Thu Dec 19 21:59:51 2002 UTC (21 years, 6 months ago) by chuckv
File length: 9955 byte(s) 
+ added lennard-jones force module and corresponding class.
+ created forceFactory directory.

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