Inheritance diagram for BALL::PolarVdWSurface:

Public Member Functions
Constructors and Destructors
	PolarVdWSurface ()

	PolarVdWSurface (const PolarVdWSurface &ps)

virtual	~PolarVdWSurface ()

Assignment
PolarVdWSurface &	operator= (const PolarVdWSurface &ps)

Public Member Functions inherited from BALL::SurfaceBase
	SurfaceBase ()

	SurfaceBase (const SurfaceBase &sb)

	SurfaceBase (const String &name)

	SurfaceBase (const String &name, const String &unit)

virtual	~SurfaceBase ()

SurfaceBase &	operator= (const SurfaceBase &sb)

void	computeAllDescriptors (AtomContainer &ac)

Public Member Functions inherited from BALL::Descriptor
	Descriptor ()

	Descriptor (const Descriptor &descriptor)

	Descriptor (const String &name)

	Descriptor (const String &name, const String &unit)

virtual	~Descriptor ()

Descriptor &	operator= (const Descriptor &descriptor)

Processor::Result	operator() (AtomContainer &ac)

const String &	getName () const

void	setName (const String &name)

void	setUnit (const String &name)

const String &	getUnit () const

virtual double	compute (AtomContainer &ac)

Public Member Functions inherited from BALL::UnaryProcessor< AtomContainer >
	UnaryProcessor ()

	UnaryProcessor (const UnaryProcessor &)

virtual	~UnaryProcessor ()

virtual bool	start ()

virtual bool	finish ()

Additional Inherited Members
Public Types inherited from BALL::UnaryFunctor< AtomContainer, Processor::Result >
typedef Processor::Result	result_type

typedef AtomContainer	argument_type

typedef AtomContainer &	argument_reference

typedef const AtomContainer &	const_argument_reference

typedef AtomContainer *	argument_pointer

typedef const AtomContainer *	const_argument_pointer

Protected Member Functions inherited from BALL::SurfaceBase
bool	isValid_ (AtomContainer &ac)

void	calculate_ (AtomContainer &ac)

Predicates

Detailed Description

This descriptor calculates the sum of atomic SAS van der Waals surface areas of the molecule, of the polar atoms.

Definition at line 203 of file surfaceDescriptors.h.

Constructor & Destructor Documentation

BALL::PolarVdWSurface::PolarVdWSurface ( )

Default Constructor

BALL::PolarVdWSurface::PolarVdWSurface ( const PolarVdWSurface & ps )

Copy constructor

virtual BALL::PolarVdWSurface::~PolarVdWSurface ( )

virtual

Destructor

PolarVdWSurface& BALL::PolarVdWSurface::operator= ( const PolarVdWSurface & ps )

Assignment operator