• Article

      The usefulness of energy decomposition schemes to rationalize host-guest interactions (2021) 

      Caramori, Giovanni Finoto; Østrøm, Ina; Ortolan, Alexandre Osmar; Nagurniak, Glaucio R.; Besen, Vitor M.; Muñoz-Castro, Alvaro; Pereira Orenha, Renato; Galembeck, Sergio Emanuel; Parreira, Renato L.T. (Royal Society of Chemistry, 2020-12-28)
      This perspective focuses on the crucial role that energy decomposition schemes play in elucidating the physical nature of non-covalent interactions in supramolecular systems, particularly from the point of view of host-guest ...