OBOrbitalData Member List

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

_alphaHOMO	OBOrbitalData	protected
_alphaOrbitals	OBOrbitalData	protected
_attr	OBGenericData	protected
_betaHOMO	OBOrbitalData	protected
_betaOrbitals	OBOrbitalData	protected
_openShell	OBOrbitalData	protected
_source	OBGenericData	protected
_type	OBGenericData	protected
Clone(OBBase *) const	OBOrbitalData	inlinevirtual
GetAlphaHOMO()	OBOrbitalData	inline
GetAlphaOrbitals()	OBOrbitalData	inline
GetAttribute() const	OBGenericData	inlinevirtual
GetBetaHOMO()	OBOrbitalData	inline
GetBetaOrbitals()	OBOrbitalData	inline
GetDataType() const	OBGenericData	inline
GetOrigin() const	OBGenericData	inlinevirtual
GetValue() const	OBGenericData	inlinevirtual
IsOpenShell()	OBOrbitalData	inline
LoadAlphaOrbitals(std::vector< double > energies, std::vector< std::string > symmetries, unsigned int alphaHOMO)	OBOrbitalData
LoadBetaOrbitals(std::vector< double > energies, std::vector< std::string > symmetries, unsigned int betaHOMO)	OBOrbitalData
LoadClosedShellOrbitals(std::vector< double > energies, std::vector< std::string > symmetries, unsigned int alphaHOMO)	OBOrbitalData
OBGenericData(const std::string attr="undefined", const unsigned int type=OBGenericDataType::UndefinedData, const DataOrigin source=any)	OBGenericData
OBOrbitalData()	OBOrbitalData	inline
operator=(const OBOrbitalData &)	OBOrbitalData
SetAlphaOrbitals(std::vector< OBOrbital > orbitalList)	OBOrbitalData	inline
SetAttribute(const std::string &v)	OBGenericData	inline
SetBetaOrbitals(std::vector< OBOrbital > orbitalList)	OBOrbitalData	inline
SetHOMO(int alpha, int beta=0)	OBOrbitalData	inline
SetOpenShell(bool openShell)	OBOrbitalData	inline
SetOrigin(const DataOrigin s)	OBGenericData	inline
~OBGenericData()	OBGenericData	inlinevirtual
~OBOrbitalData()	OBOrbitalData	inlinevirtual