5 hours later…
5:31 AM
@neversaint I'm only saying that I am not aware of a Python script which would «digest» a SMILES string of a sequence of amino acids /amino acid by amino acid/ to report the three-letter code or the Fasta one-letter code.
One potential hurdle in writing such a script would be that there are multiple dialects of SMILES (universal, inchified, canonical, etc), which may represent the same structure with a different string. (cf. open-babel.readthedocs.io/en/latest/FileFormats/…).
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Modeling Matters!
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