ambit2.base.data

Interface IModel

public interface IModel

Moved here for compatibility, since qsar package is removed from CDK > 1.3.4 Classes that implement this interface will build statistical models. Currently the design of the modeling system is that classes based on a given backend should be based of an abtract class that implements this interface. See RModel as an example.

Author:

Rajarshi Guha

Method Summary

Modifier and Type	Method and Description
void	build() Builds (trains) the model.
void	predict() Makes predictions using a previously built model.

Method Detail

build

void build()
    throws QSARModelException

Builds (trains) the model.

Throws:

QSARModelException - if errors occur in data types, calls to the R session. See the corresponding method in subclasses of this class for further details.

predict

void predict()
      throws QSARModelException

Makes predictions using a previously built model.

Throws:

QSARModelException - if errors occur in data types, calls to the R session. See the corresponding method in subclasses of this class for further details.