Service type: Local Services
The following options are available for local services:
Java Archive (JAR): Browse the JAVA Archive file, which contains the classes of the desired calculation.
Select a function: The JAR file may contain more calculation implementations; browse and select the relevant class and method.
Type: The type of the parameters defined in the signature of the JAVA method.
Name: The name of the input parameters. Enter a name, if the name is not defined in the relevant JAR file.
Evaluation: Specify how the parameters are passed to the service. Select from the following:
Chemical Terms: Evaluate the given Chemical Terms expression on the input molecule and pass the evaluation result to the service as a parameter.
Active molecule: The service will use the active molecule of MarvinSketch for the calculations.
Active selection: The service will use the selected part of the molecule in MarvinSketch for the calculations.
Manual: The value of the parameter is read from the Value field.
Value: Set a default value for the input parameter (in case of Manual evaluation) or set the parameters for evaluation. Value can be overwritten on the calculation info panel.