Zeitschriftenartikel (189)
151.
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96 (3), S. 925 - 938 (2009)
Determinants of water permeability through nanoscopic hydrophilic channels. Biophysical Journal 152.
Zeitschriftenartikel
6 (1), S. 3 - 4 (2009)
Predicting free energy changes using structural ensembles. Nature Methods 153.
Zeitschriftenartikel
36 (6), S. 1433 - 1437 (2008)
Residual dipolar couplings as a tool to study molecular recognition of ubiquitin. Biochemical Society Transactions 154.
Zeitschriftenartikel
16 (8), S. 1175 - 1182 (2008)
The atomistic mechanism of conformational transition in adenylate kinase: a TEE-REX molecular dynamics study. Structure 155.
Zeitschriftenartikel
41 (3), S. 139 - 155 (2008)
Self-consistent residual dipolar coupling based model-free analysis for the robust determination of nanosecond to microsecond protein dynamics. Journal of Biomolecular NMR 156.
Zeitschriftenartikel
320 (5882), S. 1471 - 1475 (2008)
Recognition dynamics up to microseconds revealed from an RDC-derived ubiquitin ensemble in solution. Science 157.
Zeitschriftenartikel
16 (6), S. 906 - 915 (2008)
Importin-β: structural and dynamic determinants of a molecular spring. Structure 158.
Zeitschriftenartikel
16 (5), S. 747 - 754 (2008)
The molecular mechanism of toxin-induced conformational changes in a potassium channel: relation to C-type inactivation. Structure 159.
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377 (2), S. 352 - 363 (2008)
Vacuolar protein sorting: two different functional states of the AAA-ATPase Vps4p. Journal of Molecular Biology 160.
Zeitschriftenartikel
105 (4), S. 1198 - 1203 (2008)
Mechanism of selectivity in aquaporins and aquaglyceroporins. Proceedings of the National Acadamy of Sciences of the United States of America 161.
Zeitschriftenartikel
95, S. 1837 - 1850 (2008)
Kinetics, statistics, and energetics of lipid membrane electroporation studied by molecular dynamics simulations. Biophysical Journal 162.
Zeitschriftenartikel
456 (4), S. 663 - 669 (2008)
Is TEA an inhibitor for human Aquaporin-1? Pfluegers Archiv 163.
Zeitschriftenartikel
95, S. 2275 - 2282 (2008)
Not only enthalpy: large entropy contribution to ion permeation barriers in single-file channels. Biophysical Journal 164.
Zeitschriftenartikel
15 (11), S. 1482 - 1492 (2007)
Geometry-based sampling of conformational transitions in proteins. Structure 165.
Zeitschriftenartikel
93 (9), S. 3156 - 3168 (2007)
Short-range order and collective dynamics of DMPC bilayers: a comparison between molecular dynamics simulations, X-ray, and neutron scattering experiments. Biophysical Journal 166.
Zeitschriftenartikel
36 (8), S. 919 - 931 (2007)
Acyl chain order parameter profiles in phospholipid bilayers: computation from molecular dynamics simulations and comparison with 2H NMR experiments. European Biophysical Journal 167.
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68 (3), S. 595 - 601 (2007)
Atomic contacts in protein structures. A detailed analysis of atomic radii, packing, and overlaps. Proteins-Structure Function and Bioinformatics 168.
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92 (11), S. 3930 - 3937 (2007)
Invariance of single-file water mobility in gramicidin-like peptidic pores as function of pore length. Biophysical Journal 169.
Zeitschriftenartikel
92, S. 4262 - 4270 (2007)
Molecular dynamics simulations using temperature-enhanced essential dynamics replica exchange. Biophysical Journal 170.
Zeitschriftenartikel
28 (12), S. 2075 - 2084 (2007)
Speeding up parallel GROMACS on high-latency networks. Journal of Computational Chemistry 171.
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127 (4), S. 831 - 846 (2006)
Molecular anatomy of a trafficking organelle. Cell 172.
Zeitschriftenartikel
14 (10), S. 1567 - 1576 (2006)
Ligand-release pathways in the pheromone-binding protein of Bombyx mori. Structure 173.
Zeitschriftenartikel
14 (9), S. 1469 - 1478 (2006)
A highly strained nuclear conformation of the exportin Cse1p revealed by molecular dynamics simulations. Structure 174.
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91 (3), S. 842 - 848 (2006)
Does CO2 permeate through Aquaporin-1? Biophysical Journal 175.
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281 (20), S. 14207 - 14214 (2006)
Quaternary Ammonium Compounds as Water Channel Blockers. Journal of Biological Chemistry 176.
Zeitschriftenartikel
358 (4), S. 1165 - 1178 (2006)
Alternate structural conformations of Streptococcus pneumoniae hyaluronan lyase: Insights into enzyme flexibility and underlying molecular mechanism of action. Journal of Molecular Biology 177.
Zeitschriftenartikel
358 (4), S. 1165 - 1178 (2006)
Alternate Structural Conformations of Streptococcus pneumoniae Hyaluronan Lyase: Insights into Enzyme Flexibility and Underlying Molecular Mechanism of Action. Journal of Molecular Biology 178.
Zeitschriftenartikel
37, S. 73 - 79 (2006)
Proteindynamik-Simulationen. Molekulare Nanomaschinen unter der Lupe. Physik in unserer Zeit 179.
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Mobility of a One-Dimensional Confined File of Water Molecules as a Function of File Length. Physical Review Letters 180.
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18, S. 20 - 22 (2006)
Prediction of protein flexibility from geometrical constraints. Bio Tech Interantional 181.
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25, S. 955 - 966 (2006)
Sequential N-to C-terminal SNARE complex assembly drives priming and fusion of secretory vesicles. EMBO Journal 182.
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5, S. 1 - 6 (2006)
Prediction of a RanGTP-induced conformational switch in the exportin CAS/Cse1p by molecular dynamics simulations. MPIbpc News 183.
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16 (12), S. 5675 - 5685 (2005)
Alternative splicing of SNAP-25 regulates secretion through nonconservative substitutions in the SNARE domain. Molecular Biology of the Cell 184.
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89 (3), S. 2113 - 2120 (2005)
Probing conformational disorder in neurotensin by two-dimensional solid-state NMR and comparison to molecular dynamics simulations. Biophysical Journal 185.
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350 (4), S. 611 - 616 (2005)
The 5 angstrom structure of heterologously expressed plant aquaporin SoPIP2;1. Journal of Molecular Biology 186.
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350 (2), S. 278 - 289 (2005)
The 4.5 Å structure of human AQP2. Journal of Molecular Biology 187.
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15 (2), S. 176 - 183 (2005)
The dynamics and energetics of water permeation and proton exclusion in aquaporins. Current Opinion in Structural Biology 188.
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44 (22), S. 3394 - 3399 (2005)
Molecular dynamics simulations of protein G challenge NMR-derived correlated backbone motions. Angewandte Chemie-International Edition 189.
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10 (4), S. 384 - 386 (2004)
Aquaporine: Die perfekten Wasserfilter der Zelle. Biospektrum Buchkapitel (7)
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Accurate calculation of free energy changes upon amino acid mutation. In: Computational Methods in Protein Evolution, S. 19 - 47 (Hg. Sikosek, T.). Springer Nature, New York (2019)
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Protein dynamics: From structure to function. In: From protein structure to function with bioinformatics, S. 393 - 425 (Hg. Rigden, D. J.). Springer, Dordrecht (2017)
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Calculation of binding free energies. In: Molecular Modeling of Proteins, S. 173 - 209 (Hg. Kukol, A.). Humana Pr.; Springer, New York, N.Y. (2015)
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Dynamics and energetics of permeation through aquaporins. What do we learn from molecular dynamics simulations? In: Aquaporins, S. 57 - 76 (Hg. Beitz, E.). Springer, Berlin (2009)
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Protein dynamics: From structure to function. In: From Protein Structure to Function with Bioinformatics, S. 217 - 249 (Hg. Rigden, D.J.). Springer, Dordrecht (2009)
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Improved GROMACS scaling on ethernet switched clusters. In: Recent advances in parallel virtual machine and message passing interface. 13th European PVM/MPI User`s Group meeting, Bonn, Germany, September 17-20, 2006, S. 404 - 405 (Hg. Mohr, B.; Larsson, T. J.; Worringen, J.; Dongarra, J.). Springer, Berlin (2006)