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    Homogeneous catalyst graph neural network: A human-interpretable graph neural network tool for ligand optimization in asymmetric catalysis

    Homogeneous catalyst graph neural network: A human-interpretable graph neural network tool for ligand optimization in asymmetric catalysis by Eduardo Aguilar-Bejarano, Ender Özcan, Raja K. Rit, Hongyi Li, Hon Wai Lam, Jonathan C. Moore, Simon Woodward, Grazziela Figueredo

    Published 2025-03-01
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