BALL::RelNumberOfRotatableSingleBonds Class Reference

This descriptor counts the fraction of the rotatble single bonds. More...

#include <simpleDescriptors.h>

Inheritance diagram for BALL::RelNumberOfRotatableSingleBonds:
Inheritance graph
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List of all members.


Public Member Functions

Constructors and Destructors
RelNumberOfRotatableSingleBonds ()
Default constructor.
RelNumberOfRotatableSingleBonds (const RelNumberOfRotatableSingleBonds &rnrsb)
Copy constructor.
virtual ~RelNumberOfRotatableSingleBonds ()
Destructor.
Assignment
RelNumberOfRotatableSingleBonds & operator= (const RelNumberOfRotatableSingleBonds &rnrsb)
Assignment operator.
double compute (AtomContainer &ac)
Accessors.

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.


Generated on Thu Aug 6 18:30:42 2009 for BALL by doxygen 1.5.8