sc::VDWShape Class Reference
The VDWShape class describes the surface of a molecule as the union of atom centered spheres, each the van der Waals radius of the atom. More...
#include <molshape.h>
Inheritance diagram for sc::VDWShape:
Public Methods | |
| VDWShape (const Ref< Molecule > &) | |
| VDWShape (const Ref< KeyVal > &) | |
| ~VDWShape () | |
| void | initialize (const Ref< Molecule > &) |
Detailed Description
The VDWShape class describes the surface of a molecule as the union of atom centered spheres, each the van der Waals radius of the atom.
The documentation for this class was generated from the following file:
Generated at Fri Jan 10 08:17:28 2003 for MPQC 2.1.3 using the documentation package Doxygen 1.2.14.