BALL::NonpolarSolvation Class Reference

SLICK nonpolar solvation component. More...

#include <nonpolarSolvation.h>

Inherits BALL::ScoringComponent.

List of all members.

Public Types
enum	CalculationMethod { CALCULATION__NONE, CALCULATION__UHLIG, CALCULATION__PCM, CALCULATION__VDW_SOLVENT, CALCULATION__VDW_INTERACTION }
Public Member Functions
Constructors and Destructors
	NonpolarSolvation ()
	Default constructor.
	NonpolarSolvation (ScoringFunction &sf)
	Constructor.
	NonpolarSolvation (const NonpolarSolvation &fhb)
	Copy constructor.
virtual	~NonpolarSolvation ()
	Destructor.
Assignment
const NonpolarSolvation &	operator= (const NonpolarSolvation &fr)
	Assignment.
virtual void	clear ()
	Clear method.
Predicates.
bool	operator== (const NonpolarSolvation &fr) const
Setup Methods
virtual bool	setup ()
	Setup method.
Accessors
virtual double	calculateScore ()
	Calculates and returns the component's energy.

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Detailed Description

SLICK nonpolar solvation component.

{ Definition:} {BALL/SORING/COMMON/nonpolarSolvation.h}