Finite-temperature effects in enzymatic reactions — Insights from QM/MM free-energy simulations

Author: Senn Hans M.   Kästner Johannes   Breidung Jürgen   Thiel Walter  

Publisher: NRC Research Press

ISSN: 1480-3291

Source: Canadian Journal of Chemistry, Vol.87, Iss.10, 2009-10, pp. : 1322-1337

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Abstract