BALL::NumberOfRotatableSingleBonds Class Reference

#include <BALL/QSAR/simpleDescriptors.h>

Inheritance diagram for BALL::NumberOfRotatableSingleBonds:
BALL::SimpleBase BALL::Descriptor BALL::UnaryProcessor< AtomContainer > BALL::UnaryFunctor< AtomContainer, Processor::Result >

List of all members.

Public Member Functions

Constructors and Destructors
 NumberOfRotatableSingleBonds ()
 NumberOfRotatableSingleBonds (const NumberOfRotatableSingleBonds &nrsb)
virtual ~NumberOfRotatableSingleBonds ()
Assignment
NumberOfRotatableSingleBondsoperator= (const NumberOfRotatableSingleBonds &nrsb)

Detailed Description

This descriptor counts the number of single bonds which are rotatable. A single bond is rotatable if it is a heavy bond, not in a ring and bounds not a lone atom like halogens.


Constructor & Destructor Documentation

BALL::NumberOfRotatableSingleBonds::NumberOfRotatableSingleBonds ( )

Default constructor

BALL::NumberOfRotatableSingleBonds::NumberOfRotatableSingleBonds ( const NumberOfRotatableSingleBonds nrsb)

Copy constructor

virtual BALL::NumberOfRotatableSingleBonds::~NumberOfRotatableSingleBonds ( ) [virtual]

Destructor


Member Function Documentation

NumberOfRotatableSingleBonds& BALL::NumberOfRotatableSingleBonds::operator= ( const NumberOfRotatableSingleBonds nrsb)

Assignment operator