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r3432
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DarkSide/ 3432 (17 years ago) by gezelter: Changes for implementing Amber force field: Added Inversions and worked on BaseAtomTypes so that they'd function with the fortran side.
Amber_FF.cpp 3432 (17 years ago) by gezelter: Changes for implementing Amber force field: Added Inversions and worked on BaseAtomTypes so that they'd function with the fortran side.
Amber_FF.hpp 3426 (17 years ago) by gezelter: Adding the Amber_FF files to OOPSE distribution
CLAYFF.cpp 2501 (19 years ago) by chuckv: Wow thats alot o' files. Now passing forceFieldOptions to all of the parsers.
CLAYFF.hpp 2487 (19 years ago) by gezelter: Adding handler for CLAY force field
DUFF.cpp 3430 (17 years ago) by cli2: Changes required for Inversions and Base Atom types. This will break OOPSE badly for a few days or so...
DUFF.hpp 2204 (20 years ago) by gezelter: xemacs has been drafted to perform our indentation services
EAM_FF.cpp 2759 (19 years ago) by tim: Adding single precision capabilities to c++ side
EAM_FF.hpp 2759 (19 years ago) by tim: Adding single precision capabilities to c++ side
ForceField.cpp 3432 (17 years ago) by gezelter: Changes for implementing Amber force field: Added Inversions and worked on BaseAtomTypes so that they'd function with the fortran side.
ForceField.hpp 3430 (17 years ago) by cli2: Changes required for Inversions and Base Atom types. This will break OOPSE badly for a few days or so...
ForceFieldCreator.hpp 2204 (20 years ago) by gezelter: xemacs has been drafted to perform our indentation services
ForceFieldFactory.cpp 2204 (20 years ago) by gezelter: xemacs has been drafted to perform our indentation services
ForceFieldFactory.hpp 2211 (20 years ago) by chrisfen: Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
Makefile 3424 (17 years ago) by gezelter: Adding infrastructure for Amber force field.
MnM_FF.cpp 3407 (17 years ago) by chuckv: Fixed typo in LJinteraction types. LJ-metal appears to work now.
MnM_FF.hpp 3385 (17 years ago) by gezelter: Changing functional form
SC_FF.cpp 2566 (19 years ago) by chuckv: Removed MixingRule from Globals. Handled by forceField now.
SC_FF.hpp 2536 (19 years ago) by tim: remove extra forceFieldOptions from SC_FF
SHAPES_FF.cpp 2759 (19 years ago) by tim: Adding single precision capabilities to c++ side
SHAPES_FF.hpp 2759 (19 years ago) by tim: Adding single precision capabilities to c++ side
doForces.F90 3397 (17 years ago) by chuckv: Checking in changes for Hefland moment calculations
doForces_interface.F90 3397 (17 years ago) by chuckv: Checking in changes for Hefland moment calculations
doForces_interface.h 3397 (17 years ago) by chuckv: Checking in changes for Hefland moment calculations
fCutoffPolicy.h 2274 (19 years ago) by gezelter: added fCutoffPolicy.h
fForceOptions.h 2787 (19 years ago) by gezelter: Massive changes for GB code with multiple ellipsoid types (a la Cleaver's paper). Also, changes in hydrodynamics code to make HydroProp a somewhat smarter class (rather than just a struct).
fSwitchingFunction.h 2715 (19 years ago) by chrisfen: added a cubic spline to switcheroo
mpiComponentPlan.h 2263 (20 years ago) by tim: replace c++ style comment in c files
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