Package qsardes.descriptor.qsarwb

Class QsarWBFingerprintEstate

java.lang.Object

qsardes.descriptor.DescriptorFingerprintEstate

qsardes.descriptor.qsarwb.QsarWBFingerprintEstate

All Implemented Interfaces:

Descriptor

public final class QsarWBFingerprintEstate
extends DescriptorFingerprintEstate

E-State fingerprints (QSAR-WB Descriptors).

Calculates E-State fingerprints using the CDK EStateFingerprinter class.

Returns EStateFP#, where # is the fragment number.

Constructor Summary

Constructors

Constructor	Description
QsarWBFingerprintEstate()

Method Summary

Methods inherited from class qsardes.descriptor.DescriptorFingerprintEstate

get_descriptor_names, get_descriptor_type, get_descriptor_values, toString

Methods inherited from class java.lang.Object

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

Constructor Details

QsarWBFingerprintEstate

public QsarWBFingerprintEstate()