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diffusion models) for de novo molecular design. Proven experience in cheminformatics pipelines using tools such as RDKit, various molecular representation and encoding methods (SMILES, SELFIES, graph-based
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diffusion models) for de novo molecular design. Proven experience in cheminformatics pipelines using tools such as RDKit, various molecular representation and encoding methods (SMILES, SELFIES, graph-based
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, graph-based models), QSAR, virtual screening, or molecular docking/simulations. Knowledge in quantum chemistry calculations and molecule dynamics. Additional expertise that is desired (but not required
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