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 > &)
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
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