Molassembler  3.0.1
Molecule graph and conformer library
AngstromPositions.h File Reference

Wrapper class to typify Angstrom scale positional information. More...

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Data Structures

class  Scine::Molassembler::AngstromPositions
 A wrapper class around Utils' PositionCollection to emphasize that the positions stored therein are in Angstrom. More...
 

Namespaces

 Scine::Molassembler
 Central library namespace.
 

Detailed Description

Wrapper class to typify Angstrom scale positional information.

Provides a class that exists purely to strongly separate position collections in bohr units and angstrom units in library interfaces