Publications of the Department (MPG.PuRe list)
Journal Article (19)
1.
Journal Article
129 (51), pp. 16126 - 16131 (2007)
Interaction of urea with amino acids: Implications for urea-induced protein denaturation. Journal of the American Chemical Society 2.
Journal Article
15 (11), pp. 1482 - 1492 (2007)
Geometry-based sampling of conformational transitions in proteins. Structure 3.
Journal Article
93 (9), pp. 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 4.
Journal Article
36 (8), pp. 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 5.
Journal Article
343 (1-2), pp. 131 - 140 (2007)
Vitrification from solution in restricted space: Formation and stabilization of amorphous nifedipine in a nanoporous silica xerogel carrier. International Journal of Pharmaceutics 6.
Journal Article
317 (5841), pp. 1072 - 1076 (2007)
Anatomy and dynamics of a supramolecular membrane protein cluster. Science 7.
Journal Article
68 (3), pp. 595 - 601 (2007)
Atomic contacts in protein structures. A detailed analysis of atomic radii, packing, and overlaps. Proteins-Structure Function and Bioinformatics 8.
Journal Article
93 (3), pp. 770 - 786 (2007)
Molecular dynamics study of slow base flipping in DNA using conformational flooding. Biophysical Journal 9.
Journal Article
92 (11), pp. 3930 - 3937 (2007)
Invariance of single-file water mobility in gramicidin-like peptidic pores as function of pore length. Biophysical Journal 10.
Journal Article
129 (21), pp. 6812 - 6819 (2007)
Ultrafast deactivation of an excited cytosine-guanine base pair in DNA. Journal of the American Chemical Society 11.
Journal Article
92, pp. 4262 - 4270 (2007)
Molecular dynamics simulations using temperature-enhanced essential dynamics replica exchange. Biophysical Journal 12.
Journal Article
157 (3), pp. 557 - 569 (2007)
Fluctuations of primary ubiquitin folding intermediates in a force clamp. Journal of Structural Biology 13.
Journal Article
330 (1-2), pp. 164 - 174 (2007)
Novel hybrid silica xerogels for stabilization and controlled release of drug. International Journal of Pharmaceutics 14.
Journal Article
126 (1), 014102 (2007)
Estimation of absolute solvent and solvation shell entropies via permutation reduction. Journal of Chemical Physics 15.
Journal Article
129 (36), pp. 10996 - 10997 (2007)
Ultrafast deactivation channel for thymine dimerization. Journal of American Chemical Society 16.
Journal Article
28 (12), pp. 2075 - 2084 (2007)
Speeding up parallel GROMACS on high-latency networks. Journal of Computational Chemistry 17.
Journal Article
46 (4), pp. 530 - 536 (2007)
Photoswitching of the fluorescent protein asFP595: Mechanism, proton pathways, and absorption spectra. Angewandte Chemie-International Edition 18.
Journal Article
46 (13), pp. 2232 - 2237 (2007)
Elastic properties of photoswitchable azobenzene polymers from molecular dynamics simulations. Angewandte Chemie International Edition 19.
Journal Article
111 (22), pp. 6220 - 6228 (2007)
Aqueous urea solutions: Structure, energetics, and urea aggregation. Journal of Physical Chemistry B