1. Department of Chemistry “Ugo Schiff” and CSGI
2. University of Florence
3. 50019 Florence
4. Italy
5. Computational Chemistry
6. Modeling and Data Sciences
7. The Procter & Gamble Company
8. West Chester
9. USA
10. 1853 Strombeek Bever
11. Belgium
12. Winton Hill Technical Center
13. Cincinnati