Inheritance diagram for BALL::ZagrebIndex:

Public Member Functions
Constructors and Destructors
	ZagrebIndex ()

	ZagrebIndex (const ZagrebIndex &zi)

virtual	~ZagrebIndex ()

Assignment
ZagrebIndex &	operator= (const ZagrebIndex &zi)

Accessors
double	compute (AtomContainer &ac)

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

	ConnectivityBase (const ConnectivityBase &cb)

	ConnectivityBase (const String &name)

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

virtual	~ConnectivityBase ()

virtual ConnectivityBase &	operator= (const ConnectivityBase &cb)

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

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::ConnectivityBase
bool	isValid_ (AtomContainer &ac)

void	calculate_ (AtomContainer &ac)

Detailed Description

This descriptor returns the Zagreb Index, which is calculated as: $ d_i^2$, over all heavy atoms

Definition at line 20 of file connectivityDescriptors.h.

Constructor & Destructor Documentation

BALL::ZagrebIndex::ZagrebIndex ( )

Default constructor

BALL::ZagrebIndex::ZagrebIndex ( const ZagrebIndex & zi )

Copy constructor

virtual BALL::ZagrebIndex::~ZagrebIndex ( )

virtual

Destructor

double BALL::ZagrebIndex::compute ( AtomContainer & ac )

virtual

Reimplemented from BALL::Descriptor.

ZagrebIndex& BALL::ZagrebIndex::operator= ( const ZagrebIndex & zi )

Assignment operator