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sc::ConnollyShape(3)		     MPQC		  sc::ConnollyShape(3)

NAME
       sc::ConnollyShape - DiscreteConnollyShape and ConnollyShape should
       produce the same	result.

SYNOPSIS
       #include	<molshape.h>

       Inherits	sc::Shape.

   Public Member Functions
       ConnollyShape (const Ref< KeyVal	> &)
       void initialize (const Ref< Molecule > &, double	probe_radius)
       void clear ()
       double distance_to_surface (const SCVector3 &r, SCVector3 *grad=0)
	   const
       void boundingbox	(double	valuemin, double valuemax, SCVector3 &p1,
	   SCVector3 &p2)

   Static Public Member	Functions
       static void print_counts	(std::ostream &=ExEnv::out0())

   Additional Inherited	Members
Detailed Description
       DiscreteConnollyShape and ConnollyShape should produce the same result.

       The discrete version is a shape union of	discrete subshapes and is
       slower. These classes describe the solvent accessible surface of	a
       molecule.

Author
       Generated automatically by Doxygen for MPQC from	the source code.

Version	2.3.1			Mon Jul	3 2017		  sc::ConnollyShape(3)

NAME | SYNOPSIS | Detailed Description | Author

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