Publications of the Department (MPG.PuRe list)
Journal Article (19)
1.
Journal Article
127 (4), pp. 831 - 846 (2006)
Molecular anatomy of a trafficking organelle. Cell 2.
Journal Article
110 (45), pp. 22842 - 22852 (2006)
Can principal components yield a dimension reduced description of protein dynamics on long time scales? Journal of Physical Chemistry B 3.
Journal Article
27, pp. 1693 - 1702 (2006)
Flooding in GROMACS: Accelerated barrier crossings in molecular dynamics. Journal of Computational Chemistry 4.
Journal Article
14 (10), pp. 1567 - 1576 (2006)
Ligand-release pathways in the pheromone-binding protein of Bombyx mori. Structure 5.
Journal Article
14 (10), pp. 1577 - 1586 (2006)
Pheromone discrimination by the pheromone-binding protein of Bombyx mori. Structure 6.
Journal Article
14 (9), pp. 1469 - 1478 (2006)
A highly strained nuclear conformation of the exportin Cse1p revealed by molecular dynamics simulations. Structure 7.
Journal Article
64 (3), pp. 700 - 710 (2006)
The planar conformation of a strained proline ring: A QM/MM study. Proteins 8.
Journal Article
91 (3), pp. 842 - 848 (2006)
Does CO2 permeate through Aquaporin-1? Biophysical Journal 9.
Journal Article
281 (20), pp. 14207 - 14214 (2006)
Quaternary Ammonium Compounds as Water Channel Blockers. Journal of Biological Chemistry 10.
Journal Article
358 (4), pp. 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 11.
Journal Article
358 (4), pp. 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 12.
Journal Article
323 (1), p. 1 - 1 (2006)
Nonequilibrium dynamics in biomolecules. Chemical Physics 13.
Journal Article
37, pp. 73 - 79 (2006)
Proteindynamik-Simulationen. Molekulare Nanomaschinen unter der Lupe. Physik in unserer Zeit 14.
Journal Article
62 (4), pp. 1053 - 1061 (2006)
Generalized correlation for biomolecular dynamics. Proteins: Structure, Function and Bioinformatics 15.
Journal Article
124 (21), 214903 (2006)
Collective Langevin dynamics of conformational motions in proteins. Journal of Chemical Physics 16.
Journal Article
96, 148101 (2006)
Mobility of a One-Dimensional Confined File of Water Molecules as a Function of File Length. Physical Review Letters 17.
Journal Article
18, pp. 20 - 22 (2006)
Prediction of protein flexibility from geometrical constraints. Bio Tech Interantional 18.
Journal Article
25, pp. 955 - 966 (2006)
Sequential N-to C-terminal SNARE complex assembly drives priming and fusion of secretory vesicles. EMBO Journal 19.
Journal Article
5, pp. 1 - 6 (2006)
Prediction of a RanGTP-induced conformational switch in the exportin CAS/Cse1p by molecular dynamics simulations. MPIbpc News Book Chapter (2)
20.
Book Chapter
Aufbau, Funktion und Diagnostik biogener Moleküle. In: Gase, Nanosysteme, Flüssigkeiten, pp. 977 - 1067 (Ed. Kleinermanns, K.). de Gruyter, Berlin (2006)
21.
Book Chapter
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, pp. 404 - 405 (Eds. Mohr, B.; Larsson, T. J.; Worringen, J.; Dongarra, J.). Springer, Berlin (2006)