Package qsardes.descriptor.qsarme

Class QsarMEFingerprintSubstructure

java.lang.Object

qsardes.descriptor.DescriptorFingerprintSubstructure

qsardes.descriptor.qsarme.QsarMEFingerprintSubstructure

All Implemented Interfaces:

Descriptor

public final class QsarMEFingerprintSubstructure
extends DescriptorFingerprintSubstructure

Substructure fingerprints (QSAR-ME Profiler 2025).

Calculates substructure fingerprints using the CDK SubstructureFingerprinter class.

Returns SubFP#, where # is the SMARTS number.

Constructor Summary

Constructors

Constructor	Description
QsarMEFingerprintSubstructure()

Method Summary

Methods inherited from class qsardes.descriptor.DescriptorFingerprintSubstructure

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

QsarMEFingerprintSubstructure

public QsarMEFingerprintSubstructure()