RDKit::FingerprintGenerator< OutputType > Member List

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

FingerprintGenerator(AtomEnvironmentGenerator< OutputType > *atomEnvironmentGenerator, FingerprintArguments *fingerprintArguments, AtomInvariantsGenerator *atomInvariantsGenerator=nullptr, BondInvariantsGenerator *bondInvariantsGenerator=nullptr, bool ownsAtomInvGenerator=false, bool ownsBondInvGenerator=false)	RDKit::FingerprintGenerator< OutputType >
fromJSON(const boost::property_tree::ptree &pt)	RDKit::FingerprintGenerator< OutputType >
getCountFingerprint(const ROMol &mol, FingerprintFuncArguments &args) const	RDKit::FingerprintGenerator< OutputType >
getCountFingerprint(const ROMol &mol, const std::vector< std::uint32_t > *fromAtoms=nullptr, const std::vector< std::uint32_t > *ignoreAtoms=nullptr, int confId=-1, AdditionalOutput *additionalOutput=nullptr, const std::vector< std::uint32_t > *customAtomInvariants=nullptr, const std::vector< std::uint32_t > *customBondInvariants=nullptr) const	RDKit::FingerprintGenerator< OutputType >	inline
getCountFingerprints(const std::vector< const ROMol * > &mols, int numThreads=1) const	RDKit::FingerprintGenerator< OutputType >
getFingerprint(const ROMol &mol, FingerprintFuncArguments &args) const	RDKit::FingerprintGenerator< OutputType >
getFingerprint(const ROMol &mol, const std::vector< std::uint32_t > *fromAtoms=nullptr, const std::vector< std::uint32_t > *ignoreAtoms=nullptr, int confId=-1, AdditionalOutput *additionalOutput=nullptr, const std::vector< std::uint32_t > *customAtomInvariants=nullptr, const std::vector< std::uint32_t > *customBondInvariants=nullptr) const	RDKit::FingerprintGenerator< OutputType >	inline
getFingerprints(const std::vector< const ROMol * > &mols, int numThreads=1) const	RDKit::FingerprintGenerator< OutputType >
getOptions()	RDKit::FingerprintGenerator< OutputType >	inline
getOptions() const	RDKit::FingerprintGenerator< OutputType >	inline
getSparseCountFingerprint(const ROMol &mol, FingerprintFuncArguments &args) const	RDKit::FingerprintGenerator< OutputType >
getSparseCountFingerprint(const ROMol &mol, const std::vector< std::uint32_t > *fromAtoms=nullptr, const std::vector< std::uint32_t > *ignoreAtoms=nullptr, int confId=-1, AdditionalOutput *additionalOutput=nullptr, const std::vector< std::uint32_t > *customAtomInvariants=nullptr, const std::vector< std::uint32_t > *customBondInvariants=nullptr) const	RDKit::FingerprintGenerator< OutputType >	inline
getSparseCountFingerprints(const std::vector< const ROMol * > &mols, int numThreads=1) const	RDKit::FingerprintGenerator< OutputType >
getSparseFingerprint(const ROMol &mol, FingerprintFuncArguments &args) const	RDKit::FingerprintGenerator< OutputType >
getSparseFingerprint(const ROMol &mol, const std::vector< std::uint32_t > *fromAtoms=nullptr, const std::vector< std::uint32_t > *ignoreAtoms=nullptr, int confId=-1, AdditionalOutput *additionalOutput=nullptr, const std::vector< std::uint32_t > *customAtomInvariants=nullptr, const std::vector< std::uint32_t > *customBondInvariants=nullptr) const	RDKit::FingerprintGenerator< OutputType >	inline
getSparseFingerprints(const std::vector< const ROMol * > &mols, int numThreads=1) const	RDKit::FingerprintGenerator< OutputType >
infoString() const	RDKit::FingerprintGenerator< OutputType >
toJSON(boost::property_tree::ptree &pt) const	RDKit::FingerprintGenerator< OutputType >
~FingerprintGenerator()	RDKit::FingerprintGenerator< OutputType >