6 #ifndef BALL_SCORING_COMPONENTS_VANDERWAALS_H
7 #define BALL_SCORING_COMPONENTS_VANDERWAALS_H
25 void update(
const vector<std::pair<Atom*, Atom*> >& pair_vector);
32 bool do_calculations_;
VanDerWaals(Options &options, ForceFieldParameters &forcefield_parameters)
AmberNonBonded * getAmberNonBonded()
void update(const vector< std::pair< Atom *, Atom * > > &pair_vector)
VanDerWaals(Electrostatic *es)