Open Babel: Member List

# 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 | `[inline, virtual]`
GetAlphaHOMO() | OBOrbitalData | `[inline]`
GetAlphaOrbitals() | OBOrbitalData | `[inline]`
GetAttribute() const | OBGenericData | `[inline, virtual]`
GetBetaHOMO() | OBOrbitalData | `[inline]`
GetBetaOrbitals() | OBOrbitalData | `[inline]`
GetDataType() const | OBGenericData | `[inline]`
GetOrigin() const | OBGenericData | `[inline, virtual]`
GetValue() const | OBGenericData | `[inline, virtual]`
IsOpenShell() | OBOrbitalData | `[inline]`
LoadAlphaOrbitals(std::vector< double > energies, std::vector< std::string > symmetries, int alphaHOMO) | OBOrbitalData |
LoadBetaOrbitals(std::vector< double > energies, std::vector< std::string > symmetries, int betaHOMO) | OBOrbitalData |
LoadClosedShellOrbitals(std::vector< double > energies, std::vector< std::string > symmetries, 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 | `[inline, virtual]`
~OBOrbitalData() | OBOrbitalData | `[inline, virtual]`

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