BALL::SolventPredicate Class Reference

#include <BALL/KERNEL/standardPredicates.h>

Inheritance diagram for BALL::SolventPredicate:

Public Member Functions
virtual bool	operator() (const Atom &atom) const
Public Member Functions inherited from BALL::ExpressionPredicate
	ExpressionPredicate ()
	ExpressionPredicate (const ExpressionPredicate &predicate)
	ExpressionPredicate (const String &argument)
virtual	~ExpressionPredicate ()
ExpressionPredicate &	operator= (const ExpressionPredicate &predicate)
virtual void	clear ()
bool	operator== (const ExpressionPredicate &predicate) const
virtual void	setArgument (const String &argument)
const String &	getArgument () const
Public Member Functions inherited from BALL::UnaryPredicate< Atom >
virtual	~UnaryPredicate ()

Additional Inherited Members
Protected Attributes inherited from BALL::ExpressionPredicate
String	argument_

Detailed Description

Predicate indicating solvent atoms. Returns true, if the atom belongs to a solvent molecule. This predicate is true if the atom is contained in a molecule with the property Molecule::IS_SOLVENT set. This is usually the case for solvents added automatically by a force field.

See Also

PeriodicBoundary::addSolvent

Definition at line 243 of file standardPredicates.h.

Member Function Documentation

virtual bool BALL::SolventPredicate::operator() ( const Atom &  atom ) const

virtual

Evaluate the predicate for the atom atom.

Parameters

atom	the atom to test

Returns

true, if the predicate is true, false otherwise

Reimplemented from BALL::ExpressionPredicate.