OpenMD 3.0
Molecular Dynamics in the Open
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Public Member Functions | |
void | setForceField (ForceField *ff) |
void | setSimulatedAtomTypes (AtomTypeSet &simtypes) |
virtual void | calcForce (InteractionData &idat) |
Public Member Functions inherited from OpenMD::VanDerWaalsInteraction | |
virtual InteractionFamily | getFamily () |
Public Member Functions inherited from OpenMD::NonBondedInteraction | |
virtual int | getHash ()=0 |
virtual RealType | getSuggestedCutoffRadius (pair< AtomType *, AtomType * > atypes)=0 |
virtual string | getName ()=0 |
Definition at line 56 of file SHAPES.hpp.
OpenMD::SHAPES::SHAPES | ( | ) |
Definition at line 57 of file SHAPES.cpp.
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virtual |
Implements OpenMD::NonBondedInteraction.
Definition at line 194 of file SHAPES.cpp.
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inline |
Definition at line 59 of file SHAPES.hpp.
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inline |
Definition at line 60 of file SHAPES.hpp.