Molecule Format Acceptance

Community Extensions Indigo
#1

Hi,

With the RDKit, Indigo, and CDK chemistry nodes become more used and expanded, and often used together within a workflow, are there any plans to allow the Molecule to Indigo node to accept RDKit and CDK molecules to save on the number of translater nodes required.

Thanks,

Simon.

#2

I created a thread for this discussion here:

http://tech.knime.org/forum/knime-developers/introducing-a-knime-molecule-type

#3

Simon,

I think the molecule to indigo nodes will already actually accept an RDKit molecule input - they 'pretend' to see it as SMILES.

Steve