Chemical Data Processing Library C++ API - Version 1.1.1
Public Member Functions | List of all members
CDPL::Chem::AtomConformer3DCoordinatesFunctor Class Reference

AtomConformer3DCoordinatesFunctor. More...

#include <AtomConformer3DCoordinatesFunctor.hpp>

Public Member Functions

 AtomConformer3DCoordinatesFunctor (std::size_t conf_idx)
 
const Math::Vector3Doperator() (const Atom &atom) const
 Returns the 3D-coordinates of the argument atom. More...
 

Detailed Description

AtomConformer3DCoordinatesFunctor.

Constructor & Destructor Documentation

◆ AtomConformer3DCoordinatesFunctor()

CDPL::Chem::AtomConformer3DCoordinatesFunctor::AtomConformer3DCoordinatesFunctor ( std::size_t  conf_idx)
inline

Member Function Documentation

◆ operator()()

const Math::Vector3D& CDPL::Chem::AtomConformer3DCoordinatesFunctor::operator() ( const Atom atom) const

Returns the 3D-coordinates of the argument atom.

Parameters
atomThe atom.
Returns
The 3D-coordinates of the atom.
See also
Chem::getConformer3DCoordinates(const Atom&, std::size_t)

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