chemCast.similarity.data
Class MCSSSimilarity

java.lang.Object
  extended by DefaultSimilarityProcessor
      extended by chemCast.similarity.data.MCSSSimilarity
All Implemented Interfaces:
ISubsetsModel

public class MCSSSimilarity
extends DefaultSimilarityProcessor
implements ISubsetsModel


Constructor Summary
MCSSSimilarity()
           
 
Method Summary
 void build()
           
 Subsets getDatasets()
           
 java.lang.Object getParameter(java.lang.Object parameter)
           
 void predict()
           
 float predict(IAtomContainersList object1, int index1, IAtomContainersList object2, int index2)
           
 void setDatasets(Subsets datasets)
           
 void setParameter(java.lang.Object parameter, java.lang.Object value)
           
 java.lang.String toString()
           
 
Methods inherited from class java.lang.Object
equals, getClass, hashCode, notify, notifyAll, wait, wait, wait
 

Constructor Detail

MCSSSimilarity

public MCSSSimilarity()
Method Detail

getDatasets

public Subsets getDatasets()
Specified by:
getDatasets in interface ISubsetsModel

predict

public float predict(IAtomContainersList object1,
                     int index1,
                     IAtomContainersList object2,
                     int index2)
              throws AmbitException
Specified by:
predict in interface ISubsetsModel
Throws:
AmbitException

setDatasets

public void setDatasets(Subsets datasets)
Specified by:
setDatasets in interface ISubsetsModel

build

public void build()
           throws QSARModelException
Throws:
QSARModelException

predict

public void predict()
             throws QSARModelException
Throws:
QSARModelException

getParameter

public java.lang.Object getParameter(java.lang.Object parameter)

setParameter

public void setParameter(java.lang.Object parameter,
                         java.lang.Object value)

toString

public java.lang.String toString()