griddata.h File Reference

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

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

This graph shows which files directly or indirectly include this file:

Go to the source code of this file.

Namespaces
namespace	OpenBabel
Classes
class	OBGridData
	Store values for numeric grids such as orbitals or electrostatic potential. More...

---

Detailed Description

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