A machine-learning technique first developed for understanding language can accurately classify reactions according to type (Nat. Mach. Intell. 2021, DOI: 10.1038/s42256-020-00284-w). The model also ...

WEST LAFAYETTE, Ind. – Machine learning has been used widely in the chemical sciences for drug design and other processes. The models that are prospectively tested for new reaction outcomes and used ...

If you follow the directions in a cake recipe, you expect to end up with a nice fluffy cake. In Idaho Falls, though, the elevation can affect these results. When baked goods don’t turn out as expected ...

The optimization of reactions used to synthesize target compounds is pivotal to chemical research and discovery, whether in developing a route for manufacturing a life-saving medicine 1 or unlocking ...

Researchers from Carnegie Mellon University and Los Alamos National Laboratory have used machine learning to create a model that can simulate reactive processes in a diverse set of organic materials ...