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Has2D OpenBabel::OBMol
Has3D OpenBabel::OBMol
has_leftover_electrons
OpenBabel::has_leftover_electrons(OBMol *mol, std::vector< int > &atomState) OpenBabel::has_leftover_electrons(OBMol *mol, std::vector< int > &atomState, std::vector< int > &bondState)
has_no_leftover_electrons OpenBabel::OBMol
HasAlphaBetaUnsat OpenBabel::OBAtom
HasAnalyticalGradients OpenBabel::OBForceField
HasAromaticBond OpenBabel::OBAtom
HasAromaticCorrected OpenBabel::OBMol
HasAromaticPerceived OpenBabel::OBMol
HasAtomTypesPerceived OpenBabel::OBMol
HasBondOfOrder OpenBabel::OBAtom
HasChainsPerceived OpenBabel::OBMol
HasChiralityPerceived OpenBabel::OBMol
HasChiralitySpecified OpenBabel::OBAtom
HasChiralVolume OpenBabel::OBAtom
HasCisTransStereo OpenBabel::OBStereoFacade
HasClass OpenBabel::OBAtomClassData
HasClosureBondsPerceived OpenBabel::OBMol
HasData
OpenBabel::OBBase::HasData(const std::string &) OpenBabel::OBBase::HasData(const char *) OpenBabel::OBBase::HasData(const unsigned int type)
HasDoubleBond OpenBabel::OBAtom
HasFixedAtoms OpenBabel::OBRotorList
HasFixedBonds OpenBabel::OBRotorList
HasFlag
OpenBabel::OBAtom::HasFlag() OpenBabel::OBBond::HasFlag() OpenBabel::OBMol::HasFlag()
HasGroups OpenBabel::OBForceField
HasHybridizationPerceived OpenBabel::OBMol
HasHydrogensAdded OpenBabel::OBMol
HasImplHForced OpenBabel::OBAtom
HasImplicitValencePerceived OpenBabel::OBMol
HasKekulePerceived OpenBabel::OBMol
HasLSSRPerceived OpenBabel::OBMol
HasMatch OpenBabel::OBSmartsPattern
HasNoHForced OpenBabel::OBAtom
HasNonSingleBond OpenBabel::OBAtom
HasNonZeroCoords OpenBabel::OBMol
HasPartialChargesPerceived OpenBabel::OBMol
HasResidue OpenBabel::OBAtom
HasRingAtomsAndBondsPerceived OpenBabel::OBMol
HasRingTypesPerceived OpenBabel::OBMol
HasSingleBond OpenBabel::OBAtom
HasSpinMultiplicityAssigned OpenBabel::OBMol
HasSquarePlanarStereo OpenBabel::OBStereoFacade
HasSSSRPerceived OpenBabel::OBMol
HasStereo OpenBabel::OBStereoFacade
HasTetrahedralStereo OpenBabel::OBStereoFacade
HtoMethyl OpenBabel::OBAtom
hydrogenValency OpenBabel
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