BALL::PositiveVdWSurface Class Reference

This descriptor calculates the sum of atomic SAS van der Waals surface areas of the molecule, where the atoms have a positive partial charge. More...

#include <surfaceDescriptors.h>

Inheritance diagram for BALL::PositiveVdWSurface:

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List of all members.

Public Member Functions
	BALL_CREATE (PositiveVdWSurface)
Constructors and Destructors
	PositiveVdWSurface ()
	Default constructor.
	PositiveVdWSurface (const PositiveVdWSurface &ps)
	Copy constrcutor.
virtual	~PositiveVdWSurface ()
	Destructor.
Assignment
PositiveVdWSurface &	operator= (const PositiveVdWSurface &ps)
	Assignment operator.

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Detailed Description

This descriptor calculates the sum of atomic SAS van der Waals surface areas of the molecule, where the atoms have a positive partial charge.