Hi,
I am wondering where is the official reference of SMILES. Is this one? Thanks.
https://www.daylight.com/dayhtml/doc/theory/theory.smiles.html
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Regards,
Peng
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Hi,
Relating protein pharmacology by ligand chemistry
https://www.ncbi.nlm.nih.gov/pubmed/17287757
I see the above papers Tanimoto coefficient. I am not sure how to use
open-babel python code to compute the similarity between two SMILES
strings. Could anybody show me how to do it? Thanks.
https: