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Kekuliser Member List

This is the complete list of members for Kekuliser, including all inherited members.

all_aromatic_atoms_ (defined in Kekuliser)Kekuliser [protected]
applySolution_(Position pos) (defined in Kekuliser)Kekuliser [protected]
aromatic_atoms_ (defined in Kekuliser)Kekuliser [protected]
aromatic_rings_ (defined in Kekuliser)Kekuliser [protected]
aromatic_systems_ (defined in Kekuliser)Kekuliser [protected]
atom_infos_ (defined in Kekuliser)Kekuliser [protected]
calculateAromaticSystems_() (defined in Kekuliser)Kekuliser [protected]
calculateDistanceScores_() (defined in Kekuliser)Kekuliser [protected]
clear() (defined in Kekuliser)Kekuliser
collectAromaticAtoms_() (defined in Kekuliser)Kekuliser [protected]
collectSystems_(Atom &atom) (defined in Kekuliser)Kekuliser [protected]
current_aromatic_system_ (defined in Kekuliser)Kekuliser [protected]
current_penalty_ (defined in Kekuliser)Kekuliser [protected]
dump() (defined in Kekuliser)Kekuliser
fixAromaticRings_() (defined in Kekuliser)Kekuliser [protected]
fixAromaticSystem_(Position it) (defined in Kekuliser)Kekuliser [protected]
getMaximumValence_() (defined in Kekuliser)Kekuliser [protected]
getPenalty_(Atom &atom, Index charge) (defined in Kekuliser)Kekuliser [protected, virtual]
getUnassignedBonds() const (defined in Kekuliser)Kekuliser
hasAromaticBonds_(Atom &atom) (defined in Kekuliser)Kekuliser [protected]
Kekuliser() (defined in Kekuliser)Kekuliser
lowest_penalty_ (defined in Kekuliser)Kekuliser [protected]
max_valence_ (defined in Kekuliser)Kekuliser [protected]
molecule_ (defined in Kekuliser)Kekuliser [protected]
rings_ (defined in Kekuliser)Kekuliser [protected]
setAromaticRings(const std::vector< std::set< Atom * > > &rings) (defined in Kekuliser)Kekuliser
setRings(const std::vector< std::set< Atom * > > &rings) (defined in Kekuliser)Kekuliser
setup(Molecule &ac) (defined in Kekuliser)Kekuliser
setUseFormalCharges(bool state) (defined in Kekuliser)Kekuliser
solutions_ (defined in Kekuliser)Kekuliser [protected]
unassigned_bonds_ (defined in Kekuliser)Kekuliser [protected]
use_formal_charges_ (defined in Kekuliser)Kekuliser [protected]
useFormalCharges() const (defined in Kekuliser)Kekuliser
~Kekuliser() (defined in Kekuliser)Kekuliser [virtual]