Woah, we’re halfway there…
Living on a prayer (and half a test set): Unblinding the data, freezing the board, and stepping into Phase 2. By Jon Swain, Maria Castellanos,
Living on a prayer (and half a test set): Unblinding the data, freezing the board, and stepping into Phase 2. By Jon Swain, Maria Castellanos,
Statistical Comparison of Blind Challenge Entries by Jon Swain Benchmarks have become ubiquitous in machine learning, from the MNIST (Modified National Institute of Standards and
Launch details for the PXR induction challenge, including the dataset, rules, and practical guidance for participants.
Lessons and reflections from the OpenADMET-ExpansionRx blind challenge — evaluating whether zero-shot ADMET predictions can be trusted in real drug discovery settings.
An introduction to the next blind challenge and why blinded datasets remain important for realistic benchmarking.
Maria Castellanos Hugo MacDermott-Opeskin Jon Ainsley Pat Walters The ExpansionRx challenge, launched on October 27, 2025, closed two weeks ago! We are extremely grateful
Maria Castellanos Hugo MacDermott-Opeskin Absorption, Distribution, Metabolism, Excretion, and Toxicity (ADMET) properties can make or break the preclinical and clinical development of small molecules.
Intermediate leaderboard release Absorption, Distribution, Metabolism, Excretion, and Toxicity (ADMET) properties can make or break the preclinical and clinical development of small molecules. At OpenADMET
Additional details on the coming challenge Absorption, Distribution, Metabolism, Excretion and Toxicity–ADMET–properties can make or break preclinical and clinical development of small molecules.
Small molecules continue to be the bricks and mortar of drug discovery globally, accounting for ~75% of FDA approvals over the last decade. Oral bioavailability,