Our research group is focused on using computational chemistry methods to explore the basis for molecular catalysis and supramolecular reactivity. Through careful computational simulations, we attempt to elucidate the underlying mechanisms governing catalytic processes, shedding light on key reaction pathways, transition states, and intermediates. Moreover, our investigations extend beyond the field of catalysis to encompass the fascinating world of supramolecular reactivity, where non-covalent interactions organise the assembly and function of molecular architectures.
We enjoy working in close contact with experimental groups. By synergistically combining computational predictions with experimental observations, we aim to push the boundaries of knowledge in catalysis and supramolecular chemistry, ultimately driving innovation and discovery in these critical fields.