RDKit: Member List

| RDKit Open-source cheminformatics and machine learning.

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RDMIF::HBond Member List

This is the complete list of members for RDMIF::HBond, including all inherited members.

getNumInteractions() const | RDMIF::HBond | inline
HBond() | RDMIF::HBond | inline
HBond(const RDKit::ROMol &mol, int confId=-1, const std::string &probeAtomType="OH", bool fixed=true, double cutoff=1.0) | RDMIF::HBond |
operator()(double x, double y, double z, double thres) const | RDMIF::HBond |
~HBond()=default | RDMIF::HBond |