toxTree.qsar
Class QSARDescriptor

java.lang.Object
  extended by toxTree.qsar.QSARDescriptor
All Implemented Interfaces:
java.io.Serializable, java.lang.Comparable<java.lang.String>

public class QSARDescriptor
extends java.lang.Object
implements java.io.Serializable, java.lang.Comparable<java.lang.String>

Encapsulating descriptor name (in a model) and descriptor calculation

Author:
nina
See Also:
Serialized Form

Field Summary
protected  boolean calculated
           
protected  org.openscience.cdk.qsar.IMolecularDescriptor descriptor
           
protected  java.lang.String descriptorClass
           
protected  java.lang.String descriptorName
           
 
Constructor Summary
QSARDescriptor(java.lang.String name, org.openscience.cdk.qsar.IMolecularDescriptor descriptor)
           
 
Method Summary
 int compareTo(java.lang.String arg0)
           
 boolean equals(java.lang.Object arg0)
           
 org.openscience.cdk.qsar.IMolecularDescriptor getDescriptor()
           
 java.lang.String getDescriptorName()
           
 boolean isCalculated()
           
 void setCalculated(boolean calculated)
           
 void setDescriptor(org.openscience.cdk.qsar.IMolecularDescriptor descriptor)
           
 void setDescriptorName(java.lang.String descriptorName)
           
 
Methods inherited from class java.lang.Object
clone, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait
 

Field Detail

descriptorName

protected java.lang.String descriptorName

descriptor

protected transient org.openscience.cdk.qsar.IMolecularDescriptor descriptor

calculated

protected boolean calculated

descriptorClass

protected java.lang.String descriptorClass
Constructor Detail

QSARDescriptor

public QSARDescriptor(java.lang.String name,
                      org.openscience.cdk.qsar.IMolecularDescriptor descriptor)
Method Detail

getDescriptor

public org.openscience.cdk.qsar.IMolecularDescriptor getDescriptor()

setDescriptor

public void setDescriptor(org.openscience.cdk.qsar.IMolecularDescriptor descriptor)

getDescriptorName

public java.lang.String getDescriptorName()

setDescriptorName

public void setDescriptorName(java.lang.String descriptorName)

isCalculated

public boolean isCalculated()

setCalculated

public void setCalculated(boolean calculated)

compareTo

public int compareTo(java.lang.String arg0)
Specified by:
compareTo in interface java.lang.Comparable<java.lang.String>

equals

public boolean equals(java.lang.Object arg0)
Overrides:
equals in class java.lang.Object


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