Chemical Data Processing Library C++ API - Version 1.2.0
CDPL::Chem::Hydrogen3DCoordinatesCalculator Member List

This is the complete list of members for CDPL::Chem::Hydrogen3DCoordinatesCalculator, including all inherited members.

calculate(const MolecularGraph &molgraph, Math::Vector3DArray &coords, bool init_coords=true)CDPL::Chem::Hydrogen3DCoordinatesCalculator
calculate(Math::Vector3DArray &coords, bool init_coords=true)CDPL::Chem::Hydrogen3DCoordinatesCalculator
getAtom3DCoordinatesCheckFunction() constCDPL::Chem::Hydrogen3DCoordinatesCalculator
getAtom3DCoordinatesFunction() constCDPL::Chem::Hydrogen3DCoordinatesCalculator
Hydrogen3DCoordinatesCalculator()CDPL::Chem::Hydrogen3DCoordinatesCalculator
Hydrogen3DCoordinatesCalculator(const MolecularGraph &molgraph, Math::Vector3DArray &coords, bool undef_only=true)CDPL::Chem::Hydrogen3DCoordinatesCalculator
setAtom3DCoordinatesCheckFunction(const AtomPredicate &func)CDPL::Chem::Hydrogen3DCoordinatesCalculator
setAtom3DCoordinatesFunction(const Atom3DCoordinatesFunction &func)CDPL::Chem::Hydrogen3DCoordinatesCalculator
setup(const MolecularGraph &molgraph)CDPL::Chem::Hydrogen3DCoordinatesCalculator
undefinedOnly(bool undef_only)CDPL::Chem::Hydrogen3DCoordinatesCalculator
undefinedOnly() constCDPL::Chem::Hydrogen3DCoordinatesCalculator
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