Tamsin Mansley and Mario Öeren's Optibrium webinar puts a QSAR in a fixed order: curate the assay, match regression or a class to the noise, hold out a test set that is scored once, and read the plot. A clearance label can still be the wrong target, because one number mixes several mechanisms.
Oct 25, 2026
Key takeaways from the Optibrium panel discussion featuring Nathan Brown, Charlotte Deane, Pat Walters, Chris Swain, and Paul Czodrowski on AI strategy, data leakage, generative risks, and LLMs in drug discovery.
Aug 28, 2026