A machine learning model trained on a high-throughput antibacterial screen increases the hit rate of drug discovery
Rahman, A. S. M. Zisanur, Liu, Chengyou, Sturm, Hunter, Hogan, Andrew M, Davis, Rebecca, Hu, Pingzhao, Cardona, Silvia T
Published in PLoS computational biology (13.10.2022)
Published in PLoS computational biology (13.10.2022)
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Deep learning-driven prediction of drug mechanism of action from large-scale chemical-genetic interaction profiles
Liu, Chengyou, Hogan, Andrew M., Sturm, Hunter, Khan, Mohd Wasif, Islam, Md. Mohaiminul, Rahman, A. S. M. Zisanur, Davis, Rebecca, Cardona, Silvia T., Hu, Pingzhao
Published in Journal of cheminformatics (12.03.2022)
Published in Journal of cheminformatics (12.03.2022)
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Mitigating Molecular Aggregation in Drug Discovery with Predictive Insights from Explainable AI
Sturm, Hunter, Teufel, Jonas, Isfeld, Kaitlin A, Friederich, Pascal, Davis, Rebecca L
Published in arXiv.org (03.06.2023)
Published in arXiv.org (03.06.2023)
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