Adding infrastructure for Amber force field.
removed MWM as an atom type property
Changes for Non-Bonded interactions.
Adding single precision capabilities to c++ side
Sutton-Chen almost done. Just need to fix do_forces to use Sutton-Chen.
Added suppport to atypes for MEAM and sutton-chen
OOPSE setup for TAP water. It's not parametrized, but OOPSE will now let me run it...
Got rid of write statements and am closer to a working shapes
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
xemacs has been drafted to perform our indentation services
adding IndexFinder which is used to select the molecules; Seperate ElectrostaticAtomTypesSectionParser into ChargeAtomTypesSectionParser and MultipoleAtomTypesSectionParser;remove print dipole option from Dump2XYZ;
added splitDipole and fixed quadrupole stuff
Electrostatic Unification Project
adding soft potential to LJ Module
merging new_design branch into OOPSE-2.0
fixed duplicate declaration foo
Making ShapeType into a ShapeAtomType, fixing some isXXX
Dear god! It runs and conserves energy!
strDUP not strCOPY
More on AtomType and DirectionalAtomType
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