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RDKit
Open-source cheminformatics and machine learning.
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#include <Chirality.h>
Public Member Functions | |
bool | operator== (const StereoInfo &other) const |
bool | operator!= (const StereoInfo &other) const |
Public Attributes | |
StereoType | type = StereoType::Unspecified |
StereoSpecified | specified = StereoSpecified::Unspecified |
unsigned | centeredOn = NOATOM |
StereoDescriptor | descriptor = StereoDescriptor::None |
std::vector< unsigned > | controllingAtoms |
Static Public Attributes | |
static const unsigned | NOATOM |
Definition at line 80 of file Chirality.h.
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inline |
Definition at line 99 of file Chirality.h.
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inline |
Definition at line 94 of file Chirality.h.
References centeredOn, controllingAtoms, descriptor, specified, and type.
unsigned RDKit::Chirality::StereoInfo::centeredOn = NOATOM |
Definition at line 90 of file Chirality.h.
Referenced by operator==().
std::vector<unsigned> RDKit::Chirality::StereoInfo::controllingAtoms |
Definition at line 92 of file Chirality.h.
Referenced by operator==().
StereoDescriptor RDKit::Chirality::StereoInfo::descriptor = StereoDescriptor::None |
Definition at line 91 of file Chirality.h.
Referenced by operator==().
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static |
Definition at line 86 of file Chirality.h.
StereoSpecified RDKit::Chirality::StereoInfo::specified = StereoSpecified::Unspecified |
Definition at line 89 of file Chirality.h.
Referenced by operator==().
StereoType RDKit::Chirality::StereoInfo::type = StereoType::Unspecified |
Definition at line 88 of file Chirality.h.
Referenced by operator==().