BALL::RelNumberOfRotatableSingleBonds Class Reference

#include <BALL/QSAR/simpleDescriptors.h>

Inheritance diagram for BALL::RelNumberOfRotatableSingleBonds:

List of all members.

Public Member Functions
Constructors and Destructors
	RelNumberOfRotatableSingleBonds ()
	RelNumberOfRotatableSingleBonds (const RelNumberOfRotatableSingleBonds &rnrsb)
virtual	~RelNumberOfRotatableSingleBonds ()
Assignment
RelNumberOfRotatableSingleBonds &	operator= (const RelNumberOfRotatableSingleBonds &rnrsb)
double	compute (AtomContainer &ac)

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Detailed Description

This descriptor counts the fraction of the rotatble single bonds. This is the number of rotatble single bonds devided by the number of single bonds.

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Constructor & Destructor Documentation

BALL::RelNumberOfRotatableSingleBonds::RelNumberOfRotatableSingleBonds

(

)

Default constructor

BALL::RelNumberOfRotatableSingleBonds::RelNumberOfRotatableSingleBonds

(

const RelNumberOfRotatableSingleBonds &

rnrsb

)

Copy constructor

virtual BALL::RelNumberOfRotatableSingleBonds::~RelNumberOfRotatableSingleBonds

(

)

[virtual]

Destructor

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Member Function Documentation

double BALL::RelNumberOfRotatableSingleBonds::compute

(

AtomContainer &

ac

)

[virtual]

Accessors

Reimplemented from BALL::Descriptor.

RelNumberOfRotatableSingleBonds& BALL::RelNumberOfRotatableSingleBonds::operator=

(

const RelNumberOfRotatableSingleBonds &

rnrsb

)

Assignment operator