griddata.h File Reference

#include <openbabel/babelconfig.h>
#include <openbabel/math/vector3.h>
#include <openbabel/generic.h>
#include <vector>

Go to the source code of this file.

Classes
class	OBGridData

Namespaces
	OpenBabel

Detailed Description

OBGenericData class to connect numeric grids (e.g., orbitals, electrostatic potential) to molecules.