THRUST 2

The researchers in Thrust 2 focuses on AI-enabled catalysts discovery and development. Led by Prof. Scott Denmark, the overall goal of this thrust is to pressure test the foundational AI agents described in Thrust 1 using catalyst discovery and development as a testbed to drive further development of foundational AI tools. In addition, we will develop new generative AI models for catalyst design, focusing on the development of chemical and enzymatic catalysts with new properties or functions.