DescriptorRingCount

java.lang.Object

qsardes.descriptor.DescriptorRingCount

All Implemented Interfaces:: Descriptor

Direct Known Subclasses:: QsarMERingCount, QsarWBRingCount

public abstract class DescriptorRingCount extends Object implements Descriptor

Ring count descriptors abstract class.

Constructor Summary

Constructors

Modifier

Constructor

Description

protected

DescriptorRingCount()
Method Summary

Modifier and Type

Method

Description

List<String>

get_descriptor_names()

Gets descriptors names.

DescriptorType

get_descriptor_type()

Gets the descriptor class type.

Map<String,String>

get_descriptor_values(AbstractMoleculeBuilder mol_build)

Calculates descriptors values.

protected abstract org.openscience.cdk.interfaces.IRingSet

get_t_ring_set(org.openscience.cdk.interfaces.IAtomContainer iac)

String

toString()

Methods inherited from class java.lang.Object
clone, equals, finalize, getClass, hashCode, notify, notifyAll, wait, wait, wait

Constructor Details
- DescriptorRingCount
  
  protected DescriptorRingCount()
Method Details
- toString
  
  public String toString()
  
  Overrides:
  
  toString in class Object
- get_descriptor_type
  
  public DescriptorType get_descriptor_type()
  
  Description copied from interface: Descriptor
  
  Gets the descriptor class type.
  
  Specified by:
  
  get_descriptor_type in interface Descriptor
  
  Returns:
  
  Descriptor class type.
- get_descriptor_names
  
  public List<String> get_descriptor_names()
  
  Description copied from interface: Descriptor
  
  Gets descriptors names.
  
  Specified by:
  
  get_descriptor_names in interface Descriptor
  
  Returns:
  
  Descriptor names.
- get_descriptor_values
  
  public Map<String,String> get_descriptor_values(AbstractMoleculeBuilder mol_build)
  
  Description copied from interface: Descriptor
  
  Calculates descriptors values.
  
  Specified by:
  
  get_descriptor_values in interface Descriptor
  
  Parameters:
  
  mol_build - Molecular builder representation.
  
  Returns:
  
  Descriptor values mapped as name:value.
- get_t_ring_set
  
  protected abstract org.openscience.cdk.interfaces.IRingSet get_t_ring_set(org.openscience.cdk.interfaces.IAtomContainer iac) throws org.openscience.cdk.exception.CDKException
  
  Throws:
  
  org.openscience.cdk.exception.CDKException