RDKit::SynthonSpaceSearch::SynthonSet Member List

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

addSynthon(int synthonSetNum, Synthon *newSynthon, const std::string &synthonId)	RDKit::SynthonSpaceSearch::SynthonSet
assessRingFormers()	RDKit::SynthonSpaceSearch::SynthonSet
assignConnectorsUsed()	RDKit::SynthonSpaceSearch::SynthonSet
buildAddAndSubtractFPs(const FingerprintGenerator< std::uint64_t > &fpGen, unsigned int numBits)	RDKit::SynthonSpaceSearch::SynthonSet
buildConnectorRegions()	RDKit::SynthonSpaceSearch::SynthonSet
buildMolecule(const std::vector< size_t > &synthonNums) const	RDKit::SynthonSpaceSearch::SynthonSet
buildProduct(const std::vector< size_t > &synthNums) const	RDKit::SynthonSpaceSearch::SynthonSet
buildProductName(const std::vector< size_t > &synthNums) const	RDKit::SynthonSpaceSearch::SynthonSet
buildSynthonFingerprints(const FingerprintGenerator< std::uint64_t > &fpGen)	RDKit::SynthonSpaceSearch::SynthonSet
enumerateToStream(std::ostream &os) const	RDKit::SynthonSpaceSearch::SynthonSet
getAddFP() const	RDKit::SynthonSpaceSearch::SynthonSet
getConnectorRegions() const	RDKit::SynthonSpaceSearch::SynthonSet
getConnectorRegionSmiles() const	RDKit::SynthonSpaceSearch::SynthonSet
getConnectors() const	RDKit::SynthonSpaceSearch::SynthonSet	inline
getConnRegFPs() const	RDKit::SynthonSpaceSearch::SynthonSet
getFingerprintOrderedSynthon(size_t setNum, size_t synthonNum) const	RDKit::SynthonSpaceSearch::SynthonSet
getFingerprintOrderedSynthonNum(size_t setNum, size_t synthonNum) const	RDKit::SynthonSpaceSearch::SynthonSet
getId() const	RDKit::SynthonSpaceSearch::SynthonSet	inline
getNumConnectors() const	RDKit::SynthonSpaceSearch::SynthonSet
getNumProducts() const	RDKit::SynthonSpaceSearch::SynthonSet
getNumRingFormers() const	RDKit::SynthonSpaceSearch::SynthonSet	inline
getRascalOrderedSynthon(size_t setNum, size_t synthonNum) const	RDKit::SynthonSpaceSearch::SynthonSet
getRascalOrderedSynthonNum(size_t setNum, size_t synthonNum) const	RDKit::SynthonSpaceSearch::SynthonSet
getSubstructureOrderedSynthon(size_t setNum, size_t synthonNum) const	RDKit::SynthonSpaceSearch::SynthonSet
getSubstructureOrderedSynthonNum(size_t setNum, size_t synthonNum) const	RDKit::SynthonSpaceSearch::SynthonSet
getSubtractFP() const	RDKit::SynthonSpaceSearch::SynthonSet
getSynthonConnectorPatterns() const	RDKit::SynthonSpaceSearch::SynthonSet	inline
getSynthons() const	RDKit::SynthonSpaceSearch::SynthonSet	inline
getSynthons(const std::vector< boost::dynamic_bitset<> > &reqSynths) const	RDKit::SynthonSpaceSearch::SynthonSet
hasAddAndSubtractFPs() const	RDKit::SynthonSpaceSearch::SynthonSet
hasFingerprints() const	RDKit::SynthonSpaceSearch::SynthonSet
initializeSearchOrders()	RDKit::SynthonSpaceSearch::SynthonSet
makeSampleMolecule(Synthon *synthon) const	RDKit::SynthonSpaceSearch::SynthonSet
makeSynthonSearchMols()	RDKit::SynthonSpaceSearch::SynthonSet
orderSynthonsForSearch(const std::function< bool(const Synthon *synthon1, const Synthon *synthon2)> &cmp)	RDKit::SynthonSpaceSearch::SynthonSet
readFromDBStream(std::istream &is, const SynthonSpace &space, std::uint32_t version)	RDKit::SynthonSpaceSearch::SynthonSet
removeEmptySynthonSets()	RDKit::SynthonSpaceSearch::SynthonSet
SynthonSet()=default	RDKit::SynthonSpaceSearch::SynthonSet
SynthonSet(const std::string &id)	RDKit::SynthonSpaceSearch::SynthonSet	inlineexplicit
SynthonSet(const SynthonSet &rhs)=delete	RDKit::SynthonSpaceSearch::SynthonSet
SynthonSet(SynthonSet &&rhs)=delete	RDKit::SynthonSpaceSearch::SynthonSet
writeToDBStream(std::ostream &os) const	RDKit::SynthonSpaceSearch::SynthonSet