Calculations with Third-Party Services

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In Marvin it is possible to integrate JAVA based local services or different webservices via the MarvinSketch GUI, which can be opened from JChem for Excel as well. This way you can include your own calculation method to a single molecule if you have a .jar file, which applies the appropriate method. You can find detailed description of how to integrate this webservice here.

 

3rd_party_Services

 

After pressing Accept button, the custom service will be available in Preferences dialog.

 

Form.Marvin_Preferences

 

If you want to apply this custom service to a molecule available on the sheet, you have to select Tools in Marvin Structure Editor window:

 

3rd_party_Services_Tools

 

After selecting the custom service, another dialog opens with the calculated value.

 

3rd_party_Services_Tools_Calculated

 


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