RDKit: Member List

| RDKit Open-source cheminformatics and machine learning.

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RDKit::AtomPDBResidueInfo Member List

This is the complete list of members for RDKit::AtomPDBResidueInfo, including all inherited members.

AtomMonomerInfo()=default | RDKit::AtomMonomerInfo |
AtomMonomerInfo(AtomMonomerType typ, std::string nm="") | RDKit::AtomMonomerInfo | inline
AtomMonomerInfo(const AtomMonomerInfo &other)=default | RDKit::AtomMonomerInfo |
AtomMonomerType enum name | RDKit::AtomMonomerInfo |
AtomPDBResidueInfo() | RDKit::AtomPDBResidueInfo | inline
AtomPDBResidueInfo(const AtomPDBResidueInfo &other)=default | RDKit::AtomPDBResidueInfo |
AtomPDBResidueInfo(const std::string &atomName, int serialNumber=0, std::string altLoc="", std::string residueName="", int residueNumber=0, std::string chainId="", std::string insertionCode="", double occupancy=1.0, double tempFactor=0.0, bool isHeteroAtom=false, unsigned int secondaryStructure=0, unsigned int segmentNumber=0) | RDKit::AtomPDBResidueInfo | inline
copy() const override | RDKit::AtomPDBResidueInfo | inlinevirtual
getAltLoc() const | RDKit::AtomPDBResidueInfo | inline
getChainId() const | RDKit::AtomPDBResidueInfo | inline
getInsertionCode() const | RDKit::AtomPDBResidueInfo | inline
getIsHeteroAtom() const | RDKit::AtomPDBResidueInfo | inline
getMonomerType() const | RDKit::AtomMonomerInfo | inline
getName() const | RDKit::AtomMonomerInfo | inline
getOccupancy() const | RDKit::AtomPDBResidueInfo | inline
getResidueName() const | RDKit::AtomPDBResidueInfo | inline
getResidueNumber() const | RDKit::AtomPDBResidueInfo | inline
getSecondaryStructure() const | RDKit::AtomPDBResidueInfo | inline
getSegmentNumber() const | RDKit::AtomPDBResidueInfo | inline
getSerialNumber() const | RDKit::AtomPDBResidueInfo | inline
getTempFactor() const | RDKit::AtomPDBResidueInfo | inline
OTHER enum value | RDKit::AtomMonomerInfo |
PDBRESIDUE enum value | RDKit::AtomMonomerInfo |
setAltLoc(const std::string &val) | RDKit::AtomPDBResidueInfo | inline
setChainId(const std::string &val) | RDKit::AtomPDBResidueInfo | inline
setInsertionCode(const std::string &val) | RDKit::AtomPDBResidueInfo | inline
setIsHeteroAtom(bool val) | RDKit::AtomPDBResidueInfo | inline
setMonomerType(AtomMonomerType typ) | RDKit::AtomMonomerInfo | inline
setName(const std::string &nm) | RDKit::AtomMonomerInfo | inline
setOccupancy(double val) | RDKit::AtomPDBResidueInfo | inline
setResidueName(const std::string &val) | RDKit::AtomPDBResidueInfo | inline
setResidueNumber(int val) | RDKit::AtomPDBResidueInfo | inline
setSecondaryStructure(unsigned int val) | RDKit::AtomPDBResidueInfo | inline
setSegmentNumber(unsigned int val) | RDKit::AtomPDBResidueInfo | inline
setSerialNumber(int val) | RDKit::AtomPDBResidueInfo | inline
setTempFactor(double val) | RDKit::AtomPDBResidueInfo | inline
UNKNOWN enum value | RDKit::AtomMonomerInfo |
~AtomMonomerInfo() | RDKit::AtomMonomerInfo | inlinevirtual