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swisstargetprediction

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engkinandatama / curated_compound_analysis

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Semi-automated pipeline for compound data curation (PubChem API) and target prediction (SwissTargetPrediction) with logging, validation, and web automation support.

bioinformatics cheminformatics python-script computational-biology open-science drug-discovery data-cleaning target-prediction selenium-automation natural-products molecular-analysis compound-curation swisstargetprediction smiles-notation
  • Updated Jul 12, 2025
  • Jupyter Notebook

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