Class KlekotaRothFingerprinter

java.lang.Object

org.openscience.cdk.fingerprint.AbstractFingerprinter

org.openscience.cdk.fingerprint.SubstructureFingerprinter

org.openscience.cdk.fingerprint.KlekotaRothFingerprinter

All Implemented Interfaces:

IFingerprinter

public class KlekotaRothFingerprinter
extends SubstructureFingerprinter

SMARTS based substructure fingerprint based on Chemical substructures that enrich for biological activity [Klekota, Justin and Roth, Frederick P.. Bioinformatics. 2008. 24]. Presence of 4860 substructures

Author:

yapchunwei

Constructor Summary

Constructors

Constructor	Description
KlekotaRothFingerprinter()

Method Summary

Methods inherited from class SubstructureFingerprinter

getBitFingerprint, getCountFingerprint, getRawFingerprint, getSize, getSubstructure

Methods inherited from class AbstractFingerprinter

getFingerprint, getParameters, getVersionDescription

Methods inherited from class Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Methods inherited from interface IFingerprinter

getFingerprint, getVersionDescription

Constructor Details

KlekotaRothFingerprinter

public KlekotaRothFingerprinter()