Publikationen von N. Otte
Alle Typen
Zeitschriftenartikel (7)
2009
Zeitschriftenartikel
30, S. 154 - 162 (2009)
Force-Field Parameters for the Simulation of Tetrahedral Intermediates of Serine Hydrolases. Journal of Computational Chemistry 2007
Zeitschriftenartikel
111, S. 5751 - 5755 (2007)
Looking at self-consistent-charge density functional tight binding from a semiempirical perspective. Journal of Physical Chemistry A
Zeitschriftenartikel
8, S. 106 - 112 (2007)
Learning from directed evolution: Further lessons from theoretical investigations into cooperative mutations in lipase enantioselectivity. ChemBioChem 2006
Zeitschriftenartikel
2, S. 452 - 461 (2006)
QM/MM free-energy perturbation compared to thermodynamic integration and umbrella sampling: Application to an enzymatic reaction. Journal of Chemical Theory and Computation 2005
Zeitschriftenartikel
18 (11), S. 509 - 514 (2005)
Combination of computational prescreening and experimental library construction can accelerate enzyme optimization by directed evolution. Protein Engineering Design & Selection 2004
Zeitschriftenartikel
5 (2), S. 214 - 223 (2004)
Learning from directed evolution: Theoretical investigations into cooperative mutations in lipase enantioselectivity. ChemBioChem 2003
Zeitschriftenartikel
21 (2), S. 67 - 73 (2003)
Directed evolution of an enantioselective Bacillus subtilis lipase. Biocatalysis and Biotransformation Hochschulschrift - Doktorarbeit (1)
2006
Hochschulschrift - Doktorarbeit
Combined Quantum Mechanical / Molecular Mechanical Investigation of Enantioselective Reactions in Lipases. Dissertation, 220 S., Heinrich-Heine-Universität Düsseldorf, Düsseldorf (2006)