29 #ifndef CDPL_CHEM_ENTITY3DFUNCTIONS_HPP
30 #define CDPL_CHEM_ENTITY3DFUNCTIONS_HPP
Definition of the preprocessor macro CDPL_CHEM_API.
#define CDPL_CHEM_API
Tells the compiler/linker which classes, functions and variables are part of the library API.
Definition of vector data types.
Entity3D.
Definition: Entity3D.hpp:46
CDPL_CHEM_API void clear3DCoordinates(Entity3D &entity)
CDPL_CHEM_API void set3DCoordinates(Entity3DContainer &cntnr, const Math::Vector3DArray &coords)
CDPL_CHEM_API bool has3DCoordinates(const Entity3D &entity)
CDPL_CHEM_API void get3DCoordinates(const AtomContainer &cntnr, Math::Vector3DArray &coords, const Atom3DCoordinatesFunction &coords_func, bool append=false)
CVector< double, 3 > Vector3D
A bounded 3 element vector holding floating point values of type double.
Definition: Vector.hpp:1637
The namespace of the Chemical Data Processing Library.