Researchers would like to use machine learning techniques to develop recipes for the material ... including for catalysts. A good catalyst is like a chemical matchmaker. It needs to be able ...

Molecular machine learning (ML) underpins critical workflows in drug discovery, material science, and catalyst optimization ...

The development of machine ... who have skills both in machine learning and chemistry to advance medicinal chemistry. "Making accurate predictions using machine learning critically depends on ...

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 ...

Researchers would like to use machine learning techniques to develop recipes for the material ... including for catalysts. A good catalyst is like a chemical matchmaker. It needs to be able ...

Researchers would like to use machine learning techniques to develop recipes for the material ... including for catalysts. A good catalyst is like a chemical matchmaker. It needs to be able ...