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Density Class Reference

This descriptor calculates the density of the molecule, by deviding the molecular weight by the van der Waals surface area. More...

#include <surfaceDescriptors.h>

Inheritance diagram for Density:

SurfaceBase Descriptor UnaryProcessor< AtomContainer > UnaryFunctor< AtomContainer, Processor::Result > List of all members.

Public Member Functions

Constructors and Destructors
 Density ()
 Default constructor.
 Density (const Density &rho)
 Copy constructor.
virtual ~Density ()
 Destructor.
Assignment
Density & operator= (const Density &rho)
 Assignmenr operator.

Detailed Description

This descriptor calculates the density of the molecule, by deviding the molecular weight by the van der Waals surface area.