Package qsardes.descriptor.qsarme

Class QsarMEInformationContent

java.lang.Object

qsardes.descriptor.DescriptorInformationContent

qsardes.descriptor.qsarme.QsarMEInformationContent

All Implemented Interfaces:

Descriptor

public final class QsarMEInformationContent
extends DescriptorInformationContent

Information content descriptors (QSAR-ME Profiler 2025).

Calculates information content descriptors.

Returns

IC# - Information content index.
TIC# - Total information content index.
SIC# - Structural information content index.
CIC# - Complementary information content index.
BIC# - Bond information content index.
MIC# - Modified information content index.
ZMIC# - Z-modified information content index.

# is the order of the neighborhood symmetry.

Constructor Summary

Constructors

Constructor	Description
QsarMEInformationContent()

Method Summary

Modifier and Type	Method	Description
protected String	get_aromatic_info(org.openscience.cdk.interfaces.IAtomContainer iac, org.openscience.cdk.interfaces.IAtom atom_p, org.openscience.cdk.interfaces.IAtom atom_i)

Methods inherited from class qsardes.descriptor.DescriptorInformationContent

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

QsarMEInformationContent

public QsarMEInformationContent()

Method Details

get_aromatic_info

protected String get_aromatic_info(org.openscience.cdk.interfaces.IAtomContainer iac,
 org.openscience.cdk.interfaces.IAtom atom_p,
 org.openscience.cdk.interfaces.IAtom atom_i)

Specified by:

get_aromatic_info in class DescriptorInformationContent