#include <FragmentCatalogParams.h>
Definition at line 25 of file FragmentCatalogParams.h.
◆ FragmentCatalogParams() [1/3]
RDKit::MolStandardize::FragmentCatalogParams::FragmentCatalogParams |
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◆ FragmentCatalogParams() [2/3]
RDKit::MolStandardize::FragmentCatalogParams::FragmentCatalogParams |
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const std::string & |
fgroupFile | ) |
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◆ FragmentCatalogParams() [3/3]
RDKit::MolStandardize::FragmentCatalogParams::FragmentCatalogParams |
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const FragmentCatalogParams & |
other | ) |
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◆ ~FragmentCatalogParams()
RDKit::MolStandardize::FragmentCatalogParams::~FragmentCatalogParams |
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◆ getFuncGroup()
const ROMol* RDKit::MolStandardize::FragmentCatalogParams::getFuncGroup |
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unsigned int |
fid | ) |
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◆ getFuncGroups()
const std::vector<std::shared_ptr<ROMol> >& RDKit::MolStandardize::FragmentCatalogParams::getFuncGroups |
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◆ getNumFuncGroups()
unsigned int RDKit::MolStandardize::FragmentCatalogParams::getNumFuncGroups |
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◆ initFromStream()
void RDKit::MolStandardize::FragmentCatalogParams::initFromStream |
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std::istream & |
ss | ) |
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◆ initFromString()
void RDKit::MolStandardize::FragmentCatalogParams::initFromString |
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const std::string & |
text | ) |
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◆ Serialize()
std::string RDKit::MolStandardize::FragmentCatalogParams::Serialize |
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const |
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◆ toStream()
void RDKit::MolStandardize::FragmentCatalogParams::toStream |
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std::ostream & |
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overridevirtual |
The documentation for this class was generated from the following file: