BALL  1.4.79
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BALL::PartialBondOrderAssignment Member List

This is the complete list of members for BALL::PartialBondOrderAssignment, including all inherited members.

abopBALL::PartialBondOrderAssignment
bond_ordersBALL::PartialBondOrderAssignment
clear()BALL::PartialBondOrderAssignment
coarsePenalty(float atom_type_penalty, float bond_length_penalty) const BALL::PartialBondOrderAssignment
coarsePenalty() const BALL::PartialBondOrderAssignment
convertToFullAssignment()BALL::PartialBondOrderAssignment
estimateAtomTypePenalty_(Atom *atom, Index atom_index, int fixed_valence, int fixed_virtual_order, int num_free_bonds, HEURISTIC_INDEX heuristic_index)BALL::PartialBondOrderAssignment
estimateBondLengthPenalty_(Index atom_index, const vector< Bond * > &free_bonds, int fixed_virtual_order, int fixed_valence, int num_free_bonds)BALL::PartialBondOrderAssignment
estimated_atom_type_penaltyBALL::PartialBondOrderAssignment
estimated_bond_length_penaltyBALL::PartialBondOrderAssignment
estimatePenalty_(bool include_heuristic_term=true, HEURISTIC_INDEX heuristic_index=SIMPLE)BALL::PartialBondOrderAssignment
finePenalty() const BALL::PartialBondOrderAssignmentinline
getAtomTypePenalty(bool include_heuristic_term=true, HEURISTIC_INDEX heuristic_index=SIMPLE)BALL::PartialBondOrderAssignment
HEURISTIC_INDEX enum nameBALL::PartialBondOrderAssignment
last_bondBALL::PartialBondOrderAssignment
MEDIUM enum valueBALL::PartialBondOrderAssignment
operator<(const PartialBondOrderAssignment &b) const BALL::PartialBondOrderAssignment
PartialBondOrderAssignment(AssignBondOrderProcessor *parent)BALL::PartialBondOrderAssignment
SIMPLE enum valueBALL::PartialBondOrderAssignment
TIGHT enum valueBALL::PartialBondOrderAssignment
~PartialBondOrderAssignment()BALL::PartialBondOrderAssignment
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