RDKit: Member List

| RDKit Open-source cheminformatics and machine learning.

Loading...
Searching...
No Matches
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 |
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 |
getId() const | RDKit::SynthonSpaceSearch::SynthonSet | inline
getNumConnectors() const | RDKit::SynthonSpaceSearch::SynthonSet |
getNumProducts() const | RDKit::SynthonSpaceSearch::SynthonSet |
getNumRingFormers() const | RDKit::SynthonSpaceSearch::SynthonSet | inline
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 |
makeSynthonSearchMols() | 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 |