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@denovochem

De Novo Chem

AI/ML Applications for Chemistry

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  1. sonorachem_api_wrapper sonorachem_api_wrapper Public

    Python

  2. py2opsin py2opsin Public

    Forked from JacksonBurns/py2opsin

    Simple Python interface to OPSIN: Open Parser for Systematic IUPAC nomenclature

    Python

  3. agave_chem agave_chem Public

    Reaction classifying and atom mapping

    Python

  4. name_to_smiles name_to_smiles Public

    Performant, comprehensive, and customizable name-to-SMILES conversion

    Python

  5. PubChemPy PubChemPy Public

    Forked from mcs07/PubChemPy

    Python wrapper for the PubChem PUG REST API.

    Python

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