AI molecular catalysis: where are we now?
Zhenzhi Tan, Qi Yang, Sanzhong Luo
Abstract
Artificial intelligence (AI) is transforming molecular catalysis by addressing long-standing challenges in retrosynthetic design, catalyst design, reaction development, and autonomous experimentation.
Topics & Concepts
ChemistryCatalysisCombinatorial chemistryOrganic chemistryMachine Learning in Materials Science