 ../
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LJ.F90
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2497
(18 years ago)
by chuckv:
Removed geometric distance mixing from individual modules and now use
force options to detemine what the deal is.
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Makefile
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2494
(18 years ago)
by chuckv:
Added support for fortran force options.
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atype.F90
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2428
(18 years ago)
by chuckv:
Sutton-chen stuff
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atype_interface.F90
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2428
(18 years ago)
by chuckv:
Sutton-chen stuff
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atype_interface.h
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2177
(19 years ago)
by gezelter:
cleaned up memory leak fix
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eam.F90
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2361
(18 years ago)
by gezelter:
simplifying long range potential array
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eam_interface.F90
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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eam_interface.h
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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electrostatic.F90
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2508
(18 years ago)
by gezelter:
made some minor changes to allow compilation with the portland group
compilers
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electrostatic_interface.F90
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2508
(18 years ago)
by gezelter:
made some minor changes to allow compilation with the portland group
compilers
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electrostatic_interface.h
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2508
(18 years ago)
by gezelter:
made some minor changes to allow compilation with the portland group
compilers
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fElectrostaticScreeningMethod.h
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2415
(18 years ago)
by chrisfen:
improvements in shifted-force
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fElectrostaticSummationMethod.h
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2409
(18 years ago)
by chrisfen:
changing how we deal with summation and screening methods
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fForceOptions.F90
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2496
(18 years ago)
by chuckv:
Further fixes for compiler issues.
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fForceOptions_interface.F90
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2522
(18 years ago)
by chuckv:
Fixed issue with symbol naming and added call to set force options in SimCreator.
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fForceOptions_interface.h
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2519
(18 years ago)
by chuckv:
Force option changes.
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fInteractionMap.h
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2432
(18 years ago)
by chuckv:
Added Sutton-Chen to force loop...
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fSwitchingFunctionType.h
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2426
(18 years ago)
by chrisfen:
Forgot to add some files
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force_globals.F90
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2361
(18 years ago)
by gezelter:
simplifying long range potential array
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gb.F90
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2518
(18 years ago)
by tim:
changed __FUNCTION__ to __func__ to match C99 standard, and then added
an autoconf test to check for __func__ usability. Changed some default
compile flags for the Sun architecture
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gb_interface.F90
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2375
(18 years ago)
by gezelter:
changing GB architecture
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gb_interface.h
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2499
(18 years ago)
by gezelter:
*** empty log message ***
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interactions.F90
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2259
(19 years ago)
by gezelter:
Breaky breaky!
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lj_interface.F90
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2497
(18 years ago)
by chuckv:
Removed geometric distance mixing from individual modules and now use
force options to detemine what the deal is.
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lj_interface.h
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2497
(18 years ago)
by chuckv:
Removed geometric distance mixing from individual modules and now use
force options to detemine what the deal is.
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neighborLists.F90
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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shapes.F90
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2361
(18 years ago)
by gezelter:
simplifying long range potential array
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shapes_interface.F90
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2214
(19 years ago)
by chrisfen:
Got rid of write statements and am closer to a working shapes
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shapes_interface.h
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2211
(19 years ago)
by chrisfen:
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
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simParallel.F90
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2287
(18 years ago)
by chuckv:
Added access to mpi logical variables
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simParallel_interface.F90
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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simParallel_interface.h
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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simulation.F90
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2432
(18 years ago)
by chuckv:
Added Sutton-Chen to force loop...
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simulation_interface.F90
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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simulation_interface.h
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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sticky.F90
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2361
(18 years ago)
by gezelter:
simplifying long range potential array
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sticky_interface.F90
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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sticky_interface.h
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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suttonchen.F90
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2534
(18 years ago)
by chuckv:
Sutton-Chen no longer segfaults or produces 0 potential, but rather
produces Inf for the potential. Progress....
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suttonchen_interface.F90
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2497
(18 years ago)
by chuckv:
Removed geometric distance mixing from individual modules and now use
force options to detemine what the deal is.
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suttonchen_interface.h
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2497
(18 years ago)
by chuckv:
Removed geometric distance mixing from individual modules and now use
force options to detemine what the deal is.
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switcheroo.F90
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2424
(18 years ago)
by chrisfen:
added in a 5th order polynomial switching function
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switcheroo_interface.F90
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2426
(18 years ago)
by chrisfen:
Forgot to add some files
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switcheroo_interface.h
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2426
(18 years ago)
by chrisfen:
Forgot to add some files
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