Kenneth F. Clark is in the Department of Early Chemical Development, Pharmaceutical Sciences, R&D, AstraZeneca, Macclesfield, SK10 2NA, UK. Chemical bonds result from the pairing of two electrons. One ...

Researchers developed a machine-learning model that can predict the structures of transition states of chemical reactions in less than a second, with high accuracy. Their model could make it easier ...

Computational Chemistry is the study of complex chemical problems using a combination of computer simulations, chemistry theory and information science. Also called cheminformatics, this field enables ...

As the world moves away from gas towards electricity as a greener power source, the to-do list goes beyond cars. The vast global manufacturing network that makes everything from our batteries to our ...