Predicting materials properties without crystal structure: deep representation learning from stoichiometry by Rhys E. A. Goodall, Alpha A. Lee

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Impedance-based forecasting of lithium-ion battery performance amid uneven usage by Penelope K. Jones, Ulrich Stimming, Alpha A. Lee

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Quantitative interpretation explains machine learning models for chemical reaction prediction and uncovers bias by Dávid Péter Kovács, William McCorkindale, Alpha A. Lee

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Identifying degradation patterns of lithium ion batteries from impedance spectroscopy using machine learning by Yunwei Zhang, Qiaochu Tang, Yao Zhang, Jiabin Wang, Ulrich Stimming, Alpha A. Lee

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Molecular Transformer: A Model for Uncertainty-Calibrated Chemical Reaction Prediction by Philippe Schwaller, Teodoro Laino, Théophile Gaudin, Peter Bolgar, Christopher A. Hunter, Costas Bekas, Alpha A. Lee

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Predictive Minisci late stage functionalization with transfer learning by Emma King-Smith, Felix A. Faber, Usa Reilly, Anton V. Sinitskiy, Qingyi Yang, Bo Liu, Dennis Hyek, Alpha A. Lee

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