1. Insilichem, Departament de Química, Universitat Autònoma de Barcelona, 08193 Bellaterra, Barcelona, Spain
2. Institute of Chemical Research of Catalonia (ICIQ), The Barcelona Institute of Science and Technology, 43007 Tarragona, Spain
3. Zymvol Biomodeling, Carrer Roc Boronat 117, 08018 Barcelona, Spain