E. Minerali

A Very Large-Scale Bioactivity Comparison of Deep Learning and Multiple Machine Learning Algorithms for Drug Discovery

Kimberley M. Zorn, Daniel H. Foil, S. Ekins, 2020 .

Evaluation of Assay Central Machine Learning Models for Rat Acute Oral Toxicity Prediction

Kimberley M. Zorn, Daniel H. Foil, S. Ekins, 2020 .

Asymmetric synthesis of novel spirocycles via a chiral phosphoric acid catalyzed desymmetrization

E. Minerali, Kimberly S. Petersen, N. J. Chambers, 2019, Tetrahedron Letters.

Machine Learning for Discovery of GSK3β Inhibitors

Sean Ekins, Daniel H. Foil, Ana C. Puhl, 2020, ACS omega.

Quantum Machine Learning Algorithms for Drug Discovery Applications

Sean Ekins, Kimberley M. Zorn, Victor O. Gawriljuk, 2021, J. Chem. Inf. Model..

Bioactivity Comparison across Multiple Machine Learning Algorithms Using over 5000 Datasets for Drug Discovery.

Sean Ekins, Thomas R Lane, Kimberley M. Zorn, 2020, Molecular pharmaceutics.

Quantum Machine Learning for Drug Discovery

K Batra, Zorn Km, Foil Dh, 2020 .

Comparing Machine Learning Algorithms for Predicting Drug-Induced Liver Injury (DILI).

Sean Ekins, Kimberley M Zorn, Thomas R Lane, 2020, Molecular pharmaceutics.