Contains results of tautomer enumeration.
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#include <Tautomer.h>
Contains results of tautomer enumeration.
Definition at line 125 of file MolStandardize/Tautomer.h.
◆ TautomerEnumeratorResult() [1/2]
RDKit::MolStandardize::TautomerEnumeratorResult::TautomerEnumeratorResult |
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◆ TautomerEnumeratorResult() [2/2]
◆ at()
const ROMOL_SPTR & RDKit::MolStandardize::TautomerEnumeratorResult::at |
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◆ begin()
const const_iterator RDKit::MolStandardize::TautomerEnumeratorResult::begin |
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◆ empty()
bool RDKit::MolStandardize::TautomerEnumeratorResult::empty |
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◆ end()
const const_iterator RDKit::MolStandardize::TautomerEnumeratorResult::end |
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◆ modifiedAtoms()
const boost::dynamic_bitset & RDKit::MolStandardize::TautomerEnumeratorResult::modifiedAtoms |
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◆ modifiedBonds()
const boost::dynamic_bitset & RDKit::MolStandardize::TautomerEnumeratorResult::modifiedBonds |
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◆ operator()()
std::vector< ROMOL_SPTR > RDKit::MolStandardize::TautomerEnumeratorResult::operator() |
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◆ operator[]()
const ROMOL_SPTR & RDKit::MolStandardize::TautomerEnumeratorResult::operator[] |
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◆ size()
size_t RDKit::MolStandardize::TautomerEnumeratorResult::size |
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◆ smiles()
std::vector< std::string > RDKit::MolStandardize::TautomerEnumeratorResult::smiles |
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◆ smilesTautomerMap()
const SmilesTautomerMap & RDKit::MolStandardize::TautomerEnumeratorResult::smilesTautomerMap |
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◆ status()
◆ tautomers()
std::vector< ROMOL_SPTR > RDKit::MolStandardize::TautomerEnumeratorResult::tautomers |
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◆ TautomerEnumerator
The documentation for this class was generated from the following file: