BALL  1.4.1
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BALL::NegativePolarVdWSurface Class Reference

#include <BALL/QSAR/surfaceDescriptors.h>

Inheritance diagram for BALL::NegativePolarVdWSurface:
BALL::SurfaceBase BALL::Descriptor BALL::UnaryProcessor< AtomContainer > BALL::UnaryFunctor< AtomContainer, Processor::Result >

List of all members.

Public Member Functions

Constructors and Destructors
 NegativePolarVdWSurface ()
 NegativePolarVdWSurface (const NegativePolarVdWSurface &nps)
virtual ~NegativePolarVdWSurface ()
Assigment
NegativePolarVdWSurfaceoperator= (const NegativePolarVdWSurface &nps)

Detailed Description

This descriptor calculates the sum of atomic SAS van der Waals surface areas of the molecule, where the partial charge of the atom is negative and the atom is a polar atom.

Definition at line 131 of file surfaceDescriptors.h.


Constructor & Destructor Documentation

Default constructor

Copy constructor

Destructor


Member Function Documentation

NegativePolarVdWSurface& BALL::NegativePolarVdWSurface::operator= ( const NegativePolarVdWSurface nps)

Assignment operator

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