Package qsardes.descriptor

Class DescriptorConstitutional

java.lang.Object

qsardes.descriptor.DescriptorConstitutional

All Implemented Interfaces:

Descriptor

Direct Known Subclasses:

QsarMEConstitutional, QsarWBConstitutional

public abstract class DescriptorConstitutional
extends Object
implements Descriptor

Constitutional descriptors abstract class.

Constructor Summary

Constructors

Modifier	Constructor	Description
protected	DescriptorConstitutional()

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 List<Map<String,AtomConstFunctionCall>>	get_weights_list()
String	toString()

Methods inherited from class java.lang.Object

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

Constructor Details

DescriptorConstitutional

protected DescriptorConstitutional()

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_weights_list

protected abstract List<Map<String,AtomConstFunctionCall>> get_weights_list()