Open Babel  3.0
Public Member Functions | List of all members
OBAromaticTyper Class Reference

#include <openbabel/typer.h>

Public Member Functions

 OBAromaticTyper ()
 
 ~OBAromaticTyper ()
 
void AssignAromaticFlags (OBMol &)
 

Detailed Description

Assigns aromatic typing to atoms and bonds.

The OBAromaticTyper class applies a set of aromatic perception rules to molecules. The code that performs typing is not usually used directly – it is usually done automatically when their corresponding values are requested of atoms or bonds.

atom->IsAromatic();
bond->IsAromatic();

Constructor & Destructor Documentation

◆ OBAromaticTyper()

OBAromaticTyper ( )
inline

◆ ~OBAromaticTyper()

~OBAromaticTyper ( )
inline

Member Function Documentation

◆ AssignAromaticFlags()

void AssignAromaticFlags ( OBMol mol)

Assign aromaticity flag to atoms and bonds.


The documentation for this class was generated from the following files: