Molassembler  1.0.0
Molecule graph and conformer library
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Public Member Functions | Data Fields
Scine::Molassembler::Shapes::Properties::DistortionInfo Struct Reference

Data type grouping distortions between shapes. More...

#include <Properties.h>

Public Member Functions

 DistortionInfo (std::vector< Vertex > passIndexMapping, double passAngularDistortion, double passChiralDistortion)
 

Data Fields

std::vector< Vertex > indexMapping
 
double angularDistortion
 
double chiralDistortion
 

Detailed Description

Data type grouping distortions between shapes.

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