RDKit: Member List

| RDKit Open-source cheminformatics and machine learning.

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RDKit::RGroupData Member List

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

add(const ROMOL_SPTR &newMol, const std::vector< int > &rlabel_attachments) | RDKit::RGroupData |
attachments | RDKit::RGroupData |
combinedMol | RDKit::RGroupData |
fingerprint | RDKit::RGroupData |
fingerprintOnBits | RDKit::RGroupData |
getCoreLabel() | RDKit::RGroupData | static
getMolLabel() | RDKit::RGroupData | static
getNumBondsToRlabels() const | RDKit::RGroupData |
getRGroupLabel(int rlabel) | RDKit::RGroupData | static
is_hydrogen | RDKit::RGroupData |
is_linker | RDKit::RGroupData |
isMolHydrogen(const ROMol &mol) | RDKit::RGroupData | static
labelled | RDKit::RGroupData |
mols | RDKit::RGroupData |
RGroupData() | RDKit::RGroupData | inline
single_fragment | RDKit::RGroupData |
smiles | RDKit::RGroupData |
smilesVect | RDKit::RGroupData |
toString() const | RDKit::RGroupData |