Peter König

Development of Effective Quantum Mechanical/Molecular Mechanical (QM/MM) Methods for Complex Biological Processes

Demian Riccardi, Patricia Schaefer, Yang Yang et al. · The Journal of Physical Chemistry B · 2006 · 302 citations

Engineering, Computational Chemistry, Biomedical Engineering +18

Color Tuning in Rhodopsins:  The Mechanism for the Spectral Shift between Bacteriorhodopsin and Sensory Rhodopsin II

Michael Hoffmann, Marius Wanko, Paul Strodel et al. · Journal of the American Chemical Society · 2006 · 206 citations

Bacteriology, Bacteriophage, Optogenetics +18

A Critical Evaluation of Different QM/MM Frontier Treatments with SCC-DFTB as the QM Method

Peter König, Michael Hoffmann, Thomas Frauenheim et al. · The Journal of Physical Chemistry B · 2005 · 163 citations

Qm Method, Engineering, Biochemistry +13

“Proton Holes” in Long-Range Proton Transfer Reactions in Solution and Enzymes:  A Theoretical Analysis

Demian Riccardi, Peter König, Xavier Prat‐Resina et al. · Journal of the American Chemical Society · 2006 · 134 citations · Full text

Engineering, Proton-coupled Electron Transfer, Computational Chemistry +16

Toward Theoretical Analyis of Long-Range Proton Transfer Kinetics in Biomolecular Pumps

Peter König, Nilanjan Ghosh, Michael Hoffmann et al. · The Journal of Physical Chemistry A · 2005 · 117 citations · Full text

Engineering, Bioelectrochemistry, Proton-coupled Electron Transfer +20