Innovators are using machine learning models to create new options for drug discovery pipelines. Innovators have introduced chemical reactivity flowcharts to help chemists interpret reaction outcomes ...

Using machine learning in drug discovery is no longer a novel procedure and has been well documented in recent literature. Now, researchers are using machine learning in unique ways. For one, they are ...

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 ...

New research published in Organic Letters from Purdue University scientists presents the design and development of chemical reactivity flowcharts that assist chemists in interpreting reaction outcomes ...