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
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