Predicting drug properties with parameter-free machine learning: pareto-optimal embedded modeling (POEM). - Andrew E. Brereton; Stephen MacKinnon; Zhaleh Safikhani; Shawn Reeves; Sana Alwash; Vijay Shahani; Andreas Windemuth (Mach. Learn. Sci. Technol., 2020)

Discovery of a Novel DCAF1 Ligand Using a Drug-Target Interaction Prediction Model: Generalizing Machine Learning to New Drug Targets. - Serah W. Kimani; Julie Owen; Stuart R. Green; Fengling Li; Yanjun Li; Aiping Dong; Peter J. Brown; Suzanne Ackloo; David Kuter; Cindy Yang; Miranda Macaskill; Stephen Scott Mackinnon; et al. (J. Chem. Inf. Model., 2023)