The group develops and applies methods of computational chemistry to model important processes in synthesis and in biochemical systems.

Our expertise includes high-level ab initio calculations, hybrid quantum mechanics/molecular mechanics (QM/MM), molecular dynamics simulations and solvation modelling.

Our research involves development, benchmarking and application of these tools to better understand reaction mechanisms, structure-activity relationships, and fundamental physical chemistry.

Please see below for an overview of our research activites.

We welcome informal enquires from prospective students/postdocs interested in working with us.