Chemical Data Processing Library C++ API - Version 1.1.1
Classes | Namespaces
MMFF94AromaticSSSRSubset.hpp File Reference

Definition of the class CDPL::ForceField::MMFF94AromaticSSSRSubset. More...

#include <vector>
#include <memory>
#include "CDPL/ForceField/APIPrefix.hpp"
#include "CDPL/Chem/FragmentList.hpp"
#include "CDPL/Chem/Fragment.hpp"
#include "CDPL/Util/BitSet.hpp"

Go to the source code of this file.

Classes

class  CDPL::ForceField::MMFF94AromaticSSSRSubset
 Implements the extraction of all rings in the SSSR of a molecular graph that are aromatic according to MMFF94 conventions. More...
 

Namespaces

 CDPL
 The namespace of the Chemical Data Processing Library.
 
 CDPL::Chem
 Contains classes and functions related to chemistry.
 
 CDPL::ForceField
 Contains classes and functions related to molecular force fields.
 

Detailed Description

Definition of the class CDPL::ForceField::MMFF94AromaticSSSRSubset.