NumberOfHydrophobicAtoms Class Reference

This descriptor return the number of hydrophobic atoms. More...

#include <simpleDescriptors.h>

Inheritance diagram for NumberOfHydrophobicAtoms:

List of all members.

Public Member Functions
Constructors and Destructors
	NumberOfHydrophobicAtoms ()
	Default constructur.
	NumberOfHydrophobicAtoms (const NumberOfHydrophobicAtoms &nha)
	Copy constructor.
	NumberOfHydrophobicAtoms (const String &expression)
	Expression constructor.
virtual	~NumberOfHydrophobicAtoms ()
	Destructor.
Acessors
const String &	getExpression () const
void	setExpression (const String &expression)
double	compute (AtomContainer &ac)
Assignment
NumberOfHydrophobicAtoms &	operator= (const NumberOfHydrophobicAtoms &nha)
	Assignment operator.

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Detailed Description

This descriptor return the number of hydrophobic atoms.

If another set of hydrophobic atoms should be considered, another expression can be set via setExpression, with an Expression string as parameter.