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RDKit
Open-source cheminformatics and machine learning.
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#include <Flippers.h>
Public Member Functions | |
| AtropisomerFlipper ()=delete | |
| AtropisomerFlipper (RWMol &mol, const Chirality::StereoInfo &si) | |
| AtropisomerFlipper (const AtropisomerFlipper &other)=delete | |
| AtropisomerFlipper (AtropisomerFlipper &&other)=delete | |
| AtropisomerFlipper & | operator= (const AtropisomerFlipper &other)=delete |
| AtropisomerFlipper & | operator= (AtropisomerFlipper &&other)=delete |
| ~AtropisomerFlipper () override=default | |
| void | flip (bool flag) override |
Public Member Functions inherited from RDKit::EnumerateStereoisomers::details::Flipper | |
| Flipper ()=default | |
| Flipper (const Flipper &other)=delete | |
| Flipper (Flipper &&other)=delete | |
| Flipper & | operator= (const Flipper &other)=delete |
| Flipper & | operator= (Flipper &&other)=delete |
| virtual | ~Flipper ()=default |
Public Attributes | |
| Bond * | dp_bond {nullptr} |
| std::vector< unsigned int > | d_ctrlAtoms |
Definition at line 88 of file Flippers.h.
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delete |
| RDKit::EnumerateStereoisomers::details::AtropisomerFlipper::AtropisomerFlipper | ( | RWMol & | mol, |
| const Chirality::StereoInfo & | si | ||
| ) |
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delete |
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delete |
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overridedefault |
Implements RDKit::EnumerateStereoisomers::details::Flipper.
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delete |
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delete |
Definition at line 101 of file Flippers.h.
Definition at line 100 of file Flippers.h.