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sc::VDWShape(3)                      MPQC                      sc::VDWShape(3)

NAME

sc::VDWShape - 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.

SYNOPSIS

#include <molshape.h> Inherits sc::UnionShape. Public Member Functions VDWShape (const Ref< Molecule > &) VDWShape (const Ref< KeyVal > &) void initialize (const Ref< Molecule > &) Additional Inherited Members 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. Author Generated automatically by Doxygen for MPQC from the source code. Version 2.3.1 Fri Feb 19 2016 sc::VDWShape(3)

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