A @natureportfolio.nature.com journal on mathematical models and computational methods/tools that help advance science in multiple disciplines. https://www.nature.com/natcomputsci
๐ขOut now! Gisbert Schneider and colleagues pair active learning and geometric deep learning to predict the outcome and site selectivity of chemical reactions from scarce data, helping to accelerate the drug discovery process. www.nature.com/articles/s43... ๐ #chemsky
