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Modellierung biomolekularer SystemePublikationen

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Publikationen

2010

Three-Dimensional Structural Model of Chicken Liver Sulfite Oxidase in its Activated Form

Utesch, T. and Mroginski, M. A.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS 1, 2159-2164. 2010

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The Protonation State of Glu181 in Rhodopsin Revisited: Interpretation of Experimental Data on the Basis of QM/MM Calculations

Fraehmcke, J. S., Wanko, M., Phatak, P., Mroginski, M. A. and Elstner, M.

JOURNAL OF PHYSICAL CHEMISTRY B 114, 11338-11352. 2010

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2011

Insights into the structure of the active site of the O-2-tolerant membrane bound [NiFe] hydrogenase of R. eutropha H16 by molecular modelling

Rippers, Y., Utesch, T., Hildebrandt, P., Zebger, I. and Mroginski, M. A.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS 13, 16146-16149. 2011

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Structure of the Chromophore Binding Pocket in the Pr State of Plant Phytochrome phyA

Mroginski, M. A., Kaminski, S., von Stetten, D., Ringsdorf, S., Gaertner, W., Essen, L.-O. and Hildebrandt, P.

JOURNAL OF PHYSICAL CHEMISTRY B 115, 1220-1231. 2011

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Elucidating photoinduced structural changes in phytochromes by the combined application of resonance Raman spectroscopy and theoretical methods

Mroginski, M. A., von Stetten, D., Kaminski, S., Escobar, F. V., Michael, N., Daminelli-Widany, G. and Hildebrandt, P.

JOURNAL OF MOLECULAR STRUCTURE 993, 15-25. 2011

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Role of the HoxZ Subunit in the Electron Transfer Pathway of the Membrane-Bound [NiFe]-Hydrogenase from Ralstonia eutropha Immobilized on Electrodes

Sezer, M., Frielingsdorf, S., Millo, D., Heidary, N., Utesch, T., Mroginski, M.-A., Friedrich, B., Hildebrandt, P., Zebger, I. and Weidinger, I. M.

JOURNAL OF PHYSICAL CHEMISTRY B 115, 10368-10374. 2011

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2012

Revealing the Absolute Configuration of the CO and CN− Ligands at the Active Site of a [NiFe] Hydrogenase

Rippers, Y., Horch, M., Hildebrandt, P., Zebger, I. and Mroginski, M. A.

ChemPhysChem 13, 3852–3856. 2012

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Mapping local electric fields in proteins at biomimetic interfaces

Schkolnik, G., Utesch, T., Salewski, J., Tenger, K., Millo, D., Kranich, A., Zebger, I., Schulz, C., Zimanyi, L., Rakhely, G., Mroginski, M. A. and Hildebrandt, P.

CHEMICAL COMMUNICATIONS 48, 70-72. 2012

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