MolEnumerator.h File Reference

#include <RDGeneral/export.h>
#include <GraphMol/RDKitBase.h>
#include <GraphMol/MolBundle.h>
#include <vector>
#include <map>
#include <string>
#include <memory>

Go to the source code of this file.

Classes
class	RDKit::MolEnumerator::MolEnumeratorOp
	abstract base class for the a molecule enumeration operation More...
class	RDKit::MolEnumerator::PositionVariationOp
	Molecule enumeration operation corresponding to position variation bonds. More...
class	RDKit::MolEnumerator::LinkNodeOp
	Molecule enumeration operation corresponding to LINKNODES. More...
struct	RDKit::MolEnumerator::MolEnumeratorParams
	Parameters used to control the molecule enumeration. More...

Namespaces
	RDKit
	Std stuff.
	RDKit::MolEnumerator

Functions
RDKIT_MOLENUMERATOR_EXPORT MolBundle	RDKit::MolEnumerator::enumerate (const ROMol &mol, const MolEnumeratorParams &params)