- QM/MM methods for biomolecular systemsHans Martin Senn
Department of Chemistry, WestCHEM and University of Glasgow, Glasgow G12 8QQ, UK
Angew Chem Int Ed Engl 48:1198-229. 2009..The resulting schemes are commonly referred to as combined or hybrid QM/MM methods. They enable the modeling of reactive biomolecular systems at a reasonable computational effort while providing the necessary accuracy...