Chemical Data Processing Library C++ API - Version 1.1.1
Public Member Functions | List of all members
CDPL::Chem::AtomArray3DCoordinatesFunctor Class Reference

AtomArray3DCoordinatesFunctor. More...

#include <AtomArray3DCoordinatesFunctor.hpp>

Public Member Functions

 AtomArray3DCoordinatesFunctor (const Math::Vector3DArray &coords, const MolecularGraph &molgraph)
 
const Math::Vector3Doperator() (const Atom &atom) const
 Returns the 3D-coordinates of the argument atom. More...
 

Detailed Description

AtomArray3DCoordinatesFunctor.

Constructor & Destructor Documentation

◆ AtomArray3DCoordinatesFunctor()

CDPL::Chem::AtomArray3DCoordinatesFunctor::AtomArray3DCoordinatesFunctor ( const Math::Vector3DArray coords,
const MolecularGraph molgraph 
)
inline

Member Function Documentation

◆ operator()()

const Math::Vector3D& CDPL::Chem::AtomArray3DCoordinatesFunctor::operator() ( const Atom atom) const

Returns the 3D-coordinates of the argument atom.

Parameters
atomThe atom.
Returns
The 3D-coordinates of the atom.

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