RDKit
Open-source cheminformatics and machine learning.
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RDKit::TopologicalTorsion::TopologicalTorsionEnvGenerator< OutputType > Member List

This is the complete list of members for RDKit::TopologicalTorsion::TopologicalTorsionEnvGenerator< OutputType >, including all inherited members.

dp_fingerprintArgumentsRDKit::AtomEnvironmentGenerator< OutputType >
getEnvironments(const ROMol &mol, FingerprintArguments *arguments, const std::vector< std::uint32_t > *fromAtoms, const std::vector< std::uint32_t > *ignoreAtoms, const int confId, const AdditionalOutput *additionalOutput, const std::vector< std::uint32_t > *atomInvariants, const std::vector< std::uint32_t > *bondInvariants, const bool hashResults=false) const overrideRDKit::TopologicalTorsion::TopologicalTorsionEnvGenerator< OutputType >virtual
getResultSize() const overrideRDKit::TopologicalTorsion::TopologicalTorsionEnvGenerator< OutputType >virtual
infoString() const overrideRDKit::TopologicalTorsion::TopologicalTorsionEnvGenerator< OutputType >virtual
~AtomEnvironmentGenerator()RDKit::AtomEnvironmentGenerator< OutputType >inlinevirtual