Search Results - "Knapp, E.W."

Negative solubility coefficient of methylated cyclodextrins in water: A theoretical study by Starikov, E.B, Bräsicke, K, Knapp, E.W, Saenger, W

“…Molecular dynamics and Monte Carlo simulations of β-cyclodextrin and its per-dimethylated derivative heptakis(2,6-di- O-methyl)-β-cyclodextrin have been…”
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Structural fluctuations of myoglobin from normal-modes, Mössbauer, Raman, and absorption spectroscopy by Melchers, B., Knapp, E.W., Parak, F., Cordone, L., Cupane, A., Leone, M.

“…A normal-mode analysis of carbon monoxymyoglobin (MbCO) and deoxymyoglobin (Mb) with 170 water molecules is performed for (54)Fe and (57)Fe. A projection is…”
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Improved pKa prediction: Combining empirical and semimicroscopic methods by Kieseritzky, Gernot, Knapp, E.W

“…Using three different methods we tried to compute 171 experimentally known pKa values of ionizable residues from 15 different proteins and compared the…”
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Energetics of Electron-Transfer and Protonation Reactions of the Quinones in the Photosynthetic Reaction Center of Rhodopseudomonas viridis by Rabenstein, Björn, Ullmann, G. Matthias, Knapp, Ernst-Walter

“…The electron-transfer reactions involving the quinones in the bacterial photosynthetic reaction center (bRC) are coupled to a proton uptake by the bRC. In this…”
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Combined NMR and computational study for azide binding to human manganese superoxide dismutase by Emmler, Th, Ayala, I., Silverman, D., Hafner, S., Galstyan, A.S., Knapp, E.W., Buntkowsky, G.

“…Human manganese superoxide dismutase (MnSOD) labeled with 3-fluorotyrosine (Tyf) was complexed with the 15N-labeled inhibitor azide ([ 15N 3 −]). The sample…”
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A Kunitz type protease inhibitor related protein is synthesized in Drosophila prepupal salivary glands and released into the moulting fluid during pupation by Kress, Horst, Jarrin, Andres, Thüroff, Eduardo, Saunders, Robert, Weise, Chris, Schmidt am Busch, Marcel, Knapp, Ernst-W, Wedde, Marianne, Vilcinskas, Andreas

“…From the Drosophila virilis late puff region 31C, we microcloned two neighbouring genes, Kil-1 and Kil-2, that encode putative Kunitz serine protease inhibitor…”
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Diffusion of water molecules in crystalline β-cyclodextrin hydrates 1 1 Color Plates for this article are on pages 167–168 by Braesicke, K., Steiner, T., Saenger, W., Knapp, E.W.

“…To understand the rapid diffusion mechanism of water molecules in the crystal lattice of hydrated β-cyclodextrin (β-CD), molecular dynamics (MD) simulations of…”
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Diffusion of water molecules in crystalline beta-cyclodextrin hydrates by Braesicke, K, Steiner, T, Saenger, W, Knapp, E W

“…To understand the rapid diffusion mechanism of water molecules in the crystal lattice of hydrated beta-cyclodextrin (beta-CD), molecular dynamics (MD)…”
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Protein dynamics. Mössbauer spectroscopy on deoxymyoglobin crystals by Parak, F, Knapp, E W, Kucheida, D

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