Publikationen von S. Metz

Zeitschriftenartikel (5)

2011
Zeitschriftenartikel
Metz, S.; Thiel, W. Theoretical studies on the reactivity of molybdenum enzymes. Coordination Chemistry Reviews 2011, 255, 1085–1103.
2010
Zeitschriftenartikel
Dieterich, J. M.; Werner, H. J.; Mata, R. A.; Metz, S.; Thiel, W. Reductive half-reaction of aldehyde oxidoreductase toward acetaldehyde: Ab initio and free energy quantum mechanical/molecular mechanical calculations. Journal of Chemical Physics 2010, 132.
Zeitschriftenartikel
Metz, S.; Thiel, W. QM/MM Studies of Xanthine Oxidase: Variations of Cofactor, Substrate, and Active-Site Glu802. Journal of Physical Chemistry B 2010, 114, 1506–1517.
2009
Zeitschriftenartikel
Metz, S.; Thiel, W. A Combined QM/MM Study on the Reductive Half-Reaction of Xanthine Oxidase: Substrate Orientation and Mechanism. Journal of the American Chemical Society 2009, 131, 14885–14902.
Zeitschriftenartikel
Metz, S.; Wang, D.; Thiel, W. Reductive Half-Reaction of Aldehyde Oxidoreductase toward Acetaldehyde: A Combined QM/MM Study. Journal of the American Chemical Society 2009, 131, 4628–4640.

Hochschulschrift - Doktorarbeit (1)

2009
Hochschulschrift - Doktorarbeit
Metz, S. QM/MM Investigations on the Hydroxylation Reactions of Molybdopterin-containing Enzymes. Doktorarbeit, Heinrich-Heine-Universität, Düsseldorf.
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