ChemApp is a Streamlit-based platform for virtual screening and early-stage drug discovery, integrating machine learning, molecular generation, fingerprinting, drug-likeness assessment, molecular docking, and interactive visualization in a unified workflow.
python data-science machine-learning ai drug-discovery qsar virtual-screening chembl autodock-vina streamlit-webapp medicinal-chemistry gen-ai structure-based-drug-design ligand-based-drug-design integrated-worflow
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Updated
Sep 17, 2026 - Python