#include <BALL/QSAR/simpleDescriptors.h>
Public Member Functions | |
Constructors and Destructors | |
NumberOfRotatableSingleBonds () | |
NumberOfRotatableSingleBonds (const NumberOfRotatableSingleBonds &nrsb) | |
virtual | ~NumberOfRotatableSingleBonds () |
Assignment | |
NumberOfRotatableSingleBonds & | operator= (const NumberOfRotatableSingleBonds &nrsb) |
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.
BALL::NumberOfRotatableSingleBonds::NumberOfRotatableSingleBonds | ( | ) |
Default constructor
BALL::NumberOfRotatableSingleBonds::NumberOfRotatableSingleBonds | ( | const NumberOfRotatableSingleBonds & | nrsb | ) |
Copy constructor
virtual BALL::NumberOfRotatableSingleBonds::~NumberOfRotatableSingleBonds | ( | ) | [virtual] |
Destructor
NumberOfRotatableSingleBonds& BALL::NumberOfRotatableSingleBonds::operator= | ( | const NumberOfRotatableSingleBonds & | nrsb | ) |
Assignment operator