There is a new KNIME forum. You can still browse and read content from our old forum but if you want to create new posts or join ongoing discussions, please visit our new KNIME forum:

CDK nodes with automatic molecule conversion

Member for

8 years 2 months Stephan
Following efforts by the KNIME team and the developers of RDKit to simplify the use of molecule types across different cheminformatics toolkits, the CDK-KNIME plug-in has also adopted automatic molecule conversion.
Using the nightly build of the plug-in, molecule type conversion, e.g., between RDKit and CDK molecules is performed automatically.
Any feedback on the CDK-KNIME plug-in and the implemented type conversion would be greatly appreciated.