Class QsarWBChiPathCluster

java.lang.Object
qsardes.descriptor.DescriptorChiPathCluster
qsardes.descriptor.qsarwb.QsarWBChiPathCluster
All Implemented Interfaces:
Descriptor

public final class QsarWBChiPathCluster extends DescriptorChiPathCluster
Chi path cluster descriptors (QSAR-WB Descriptors).

Calculates chi path cluster descriptors using the CDK ChiPathClusterDescriptor class.

Returns

SPC-# - Simple path cluster order #.
VPC-# - Valence path cluster order #.

# is the order spanning from 4 to 6.
  • Constructor Details

    • QsarWBChiPathCluster

      public QsarWBChiPathCluster()