How to generate Inchi Key using Marvin Bean

User aa106075ff

04-02-2009 16:54:26

I am new to Marvin. I was wondering is there any method (function) in


Marvin beans that converts inchi code (or smiles) to inchi key like we use


toFormat("inchi:AuxNone") to convert smiles etc into inchi code.





I will be thankful for your help.





regards,





Muhammed

ChemAxon 0a9e2a55e1

05-02-2009 14:09:09

Hi,














The new InChI software including InChIkey was beta till the middle of January. We are working on changing InChI in marvin to the new version, but because of the release we had many more important tasks. We will implement this soon.














Best Regards,





Peter