Scine::Molassembler::IO::SmilesBondStereo Struct Reference

Helper class to represent the stereo configuration of a double bond as indicated in a SMILES string. More...

#include <SmilesBondStereo.h>

Public Member Functions
unsigned	findAssignment (BondStereopermutator stereopermutator, const Molecule &mol, const std::vector< PrivateGraph::Vertex > &indexInComponentMap) const

Data Fields
boost::optional < PrivateGraph::Vertex >	left
PrivateGraph::Vertex	right
boost::optional < PrivateGraph::Vertex >	upOfLeft
boost::optional < PrivateGraph::Vertex >	downOfLeft
boost::optional < PrivateGraph::Vertex >	upOfRight
boost::optional < PrivateGraph::Vertex >	downOfRight

Detailed Description

Helper class to represent the stereo configuration of a double bond as indicated in a SMILES string.

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The documentation for this struct was generated from the following file:

• Molassembler/IO/SmilesBondStereo.h