addExcludePattern(const MolecularGraph::SharedPointer &match_ptn, unsigned int rule_id) | CDPL::Chem::FragmentGenerator | |
addExcludePattern(const MolecularGraph::SharedPointer &match_ptn) | CDPL::Chem::FragmentGenerator | |
addExcludePattern(const ExcludePattern &excl_ptn) | CDPL::Chem::FragmentGenerator | |
addFragmentationRule(const MolecularGraph::SharedPointer &match_ptn, unsigned int rule_id) | CDPL::Chem::FragmentGenerator | |
addFragmentationRule(const FragmentationRule &rule) | CDPL::Chem::FragmentGenerator | |
clearExcludePatterns() | CDPL::Chem::FragmentGenerator | |
clearFragmentationRules() | CDPL::Chem::FragmentGenerator | |
ConstExcludePatternIterator typedef | CDPL::Chem::FragmentGenerator | |
ConstFragmentationRuleIterator typedef | CDPL::Chem::FragmentGenerator | |
ConstFragmentLinkIterator typedef | CDPL::Chem::FragmentGenerator | |
ExcludePatternIterator typedef | CDPL::Chem::FragmentGenerator | |
FragmentationRuleIterator typedef | CDPL::Chem::FragmentGenerator | |
FragmentFilterFunction typedef | CDPL::Chem::FragmentGenerator | |
FragmentGenerator() | CDPL::Chem::FragmentGenerator | |
FragmentGenerator(const FragmentGenerator &gen) | CDPL::Chem::FragmentGenerator | |
generate(const MolecularGraph &molgraph, FragmentList &frag_list, bool append=false) | CDPL::Chem::FragmentGenerator | |
getExcludePattern(std::size_t idx) const | CDPL::Chem::FragmentGenerator | |
getExcludePattern(std::size_t idx) | CDPL::Chem::FragmentGenerator | |
getExcludePatternsBegin() const | CDPL::Chem::FragmentGenerator | |
getExcludePatternsBegin() | CDPL::Chem::FragmentGenerator | |
getExcludePatternsEnd() const | CDPL::Chem::FragmentGenerator | |
getExcludePatternsEnd() | CDPL::Chem::FragmentGenerator | |
getFragmentationRule(std::size_t idx) const | CDPL::Chem::FragmentGenerator | |
getFragmentationRule(std::size_t idx) | CDPL::Chem::FragmentGenerator | |
getFragmentationRulesBegin() const | CDPL::Chem::FragmentGenerator | |
getFragmentationRulesBegin() | CDPL::Chem::FragmentGenerator | |
getFragmentationRulesEnd() const | CDPL::Chem::FragmentGenerator | |
getFragmentationRulesEnd() | CDPL::Chem::FragmentGenerator | |
getFragmentFilterFunction() const | CDPL::Chem::FragmentGenerator | |
getFragmentLink(std::size_t idx) const | CDPL::Chem::FragmentGenerator | |
getFragmentLinksBegin() const | CDPL::Chem::FragmentGenerator | |
getFragmentLinksEnd() const | CDPL::Chem::FragmentGenerator | |
getNumExcludePatterns() const | CDPL::Chem::FragmentGenerator | |
getNumFragmentationRules() const | CDPL::Chem::FragmentGenerator | |
getNumFragmentLinks() const | CDPL::Chem::FragmentGenerator | |
includeSplitBonds(bool include) | CDPL::Chem::FragmentGenerator | |
operator=(const FragmentGenerator &gen) | CDPL::Chem::FragmentGenerator | |
RECAPFragmentGenerator() | CDPL::Chem::RECAPFragmentGenerator | |
removeExcludePattern(std::size_t idx) | CDPL::Chem::FragmentGenerator | |
removeFragmentationRule(std::size_t idx) | CDPL::Chem::FragmentGenerator | |
setFragmentFilterFunction(const FragmentFilterFunction &func) | CDPL::Chem::FragmentGenerator | |
SharedPointer typedef | CDPL::Chem::RECAPFragmentGenerator | |
splitBondsIncluded() const | CDPL::Chem::FragmentGenerator | |
~FragmentGenerator() | CDPL::Chem::FragmentGenerator | inlinevirtual |