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Laura Shub

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2020 – today

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2024
[j2]
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Zachary J. Gale-Day, Laura Shub, Kangway V. Chuang, Michael J. Keiser:
Proximity Graph Networks: Predicting Ligand Affinity with Message Passing Neural Networks. J. Chem. Inf. Model. 64(14): 5439-5450 (2024)
2022
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Alexandre V. Fassio, Laura Shub, Luca Ponzoni, Jessica McKinley, Matthew J. O'Meara, Rafaela Salgado Ferreira, Michael J. Keiser, Raquel Cardoso de Melo Minardi:
Prioritizing Virtual Screening with Interpretable Interaction Fingerprints. J. Chem. Inf. Model. 62(18): 4300-4318 (2022)

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