All,
Markus points something out to me that is really important in understanding
how OPSIN works:
"may I correct you in one detail: OPSIN is a library that is capable
of converting a systematic IUPAC name into a SMILES string - no
database is used for that - it is 'just' an algorithm"
This is a conversion, not a look-up.
Otis
--
Otis Rothenberger
Department of Chemistry
Illinois State University
Normal, IL 61790-4160
http://chemagic.org
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