Molassembler  3.0.0
Molecule graph and conformer library
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Scine::Molassembler::RankingTree::VertexData Struct Reference

Data class that sets which supplementary data is stored for a tree vertex. More...

#include <RankingTree.h>

Data Fields

AtomIndex molIndex
 The original molecule index this vertex represents.
 
bool isDuplicate
 Whether this vertex in the tree represents a duplicate.
 
boost::optional
< AtomStereopermutator
stereopermutatorOption
 A vertex-central stereopermutator may be instantiated here or may not.
 

Detailed Description

Data class that sets which supplementary data is stored for a tree vertex.


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