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Our research group focuses on the use of computational chemistry methods to explore the fundamentals of molecular catalysis and supramolecular reactivity. Through accurate computational simulations, we try to elucidate the underlying mechanisms that govern catalytic processes, shedding light on key reaction pathways, transition states and intermediates. In addition, our research goes beyond the field of catalysis to encompass the fascinating world of supramolecular reactivity, where non-covalent interactions organize the assembly and function of molecular architectures.
We like to work in close contact with experimental groups. By synergistic combination of computational predictions with experimental observations, we aspire to expand the boundaries of knowledge in catalysis and supramolecular chemistry, ultimately driving innovation and discovery in these relevant fields.
A photograph of some of us at a recent congress:
