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Citation: W. Van Gunsteren et al., Molecular dynamics simulation of biomolecular systems, CHIMIA, 55(10), 2001, pp. 856-860

Authors: Kollman, PA Kuhn, B Donini, O Perakyla, M Stanton, R Bakowies, D

Citation: Pa. Kollman et al., Elucidating the nature of enzyme catalysis utilizing a new twist on an oldmethodology: Quantum mechanical - Free energy calculations on chemical reactions in enzymes and in aqueous solution, ACC CHEM RE, 34(1), 2001, pp. 72-79

Authors: Bakowies, D Kollman, PA

Citation: D. Bakowies et Pa. Kollman, Theoretical study of base-catalyzed amide hydrolysis: Gas- and aqueous-phase hydrolysis of formamide, J AM CHEM S, 121(24), 1999, pp. 5712-5726