Revision
371 -
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Modified
Thu Mar 20 17:26:37 2003 UTC
(21 years, 5 months ago)
by
chuckv
Diff to
previous 370
Fixed bugs in atype_module.F90
atype_module.F90:new_atype: status was reused for force field checks, created
new variable FFcheckStatus to be result of FF checks.
Revision
368 -
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Modified
Thu Mar 20 00:02:39 2003 UTC
(21 years, 5 months ago)
by
chuckv
Diff to
previous 367
Fixed bugs. Single version now runs w/o segfault. Still a conservation of energy bug.
do_Forces.F90: Fixed pot not being passed to do_pair.
neighborLists.F90: Fixed bugs in checkNeighborLists
atype_module.F90: Fixed bug with allocating atypes on each new_atype call.Now checks to see if atypes is null, then calles initialize(16).
vector_class.F90: Fixed some bugs with how MatchList was being allocated.
Revision
348 -
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Modified
Fri Mar 14 21:33:10 2003 UTC
(21 years, 5 months ago)
by
mmeineke
Diff to
previous 347
mostly compiles. interface twixt c and fortran is broken. (c needs to be brought up to date with fortran.)
Revision
289 -
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Modified
Thu Feb 27 18:47:45 2003 UTC
(21 years, 6 months ago)
by
mmeineke
Diff to
previous 288
added randomSPRNG.hpp to the package (oops, should have beenthere to begin with.)
added ssdFF++.cpp to the makefile
Revision
287 -
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Modified
Thu Feb 27 18:39:55 2003 UTC
(21 years, 6 months ago)
by
mmeineke
Diff to
previous 285
fixed some changes to the Globals in libBASS
Added some files to the Makefile and added ssdFF++.cpp to the C++ side of things
Revision
285 -
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Modified
Wed Feb 26 18:45:57 2003 UTC
(21 years, 6 months ago)
by
mmeineke
Diff to
previous 278
OOPSE has been braought up to date with the mdtools devfelopment tree. mdtools should no longer be used. All development should take place in the OOPSE tree.