BALL::RelNumberOfRotatableSingleBonds Class Reference

#include <BALL/QSAR/simpleDescriptors.h>

Inheritance diagram for BALL::RelNumberOfRotatableSingleBonds:

[legend]

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.

Definition at line 820 of file simpleDescriptors.h.

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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