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Papers authored by Grubmüller H

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Kinase-activity-independent functions of atypical protein kinase C in Drosophila.

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Kim S, Gailite I, Moussian B, Luschnig S, Goette M, Fricke K, Honemann-Capito M, Grubmüller H, and Wodarz A

Journal of cell science 122(Pt 20):3759-71, 2009 Oct 15 - Who cited this? | PubMed ID: 19789180 | Fulltext

Molecular determinants of snurportin 1 ligand affinity and structural response upon binding.

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Goette M, Stumpe MC, Ficner R, and Grubmüller H

Biophysical journal 97(2):581-9, 2009 Jul 22 - Who cited this? | PubMed ID: 19619473 | Fulltext

Primary steps of pH-dependent insulin aggregation kinetics are governed by conformational flexibility.

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Haas J, Vöhringer-Martinez E, Bögehold A, Matthes D, Hensen U, Pelah A, Abel B, and Grubmüller H

Chembiochem : a European journal of chemical biology 10(11):1816-22, 2009 Jul 20 - Who cited this? | PubMed ID: 19533727 | Fulltext

Adaptive anisotropic kernels for nonparametric estimation of absolute configurational entropies in high-dimensional configuration spaces.

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Hensen U, Grubmüller H, and Lange OF

Physical review. E, Statistical, nonlinear, and soft matter physics 80(1 Pt 1):011913, 2009 Jul - Who cited this? | PubMed ID: 19658735 | Fulltext

Urea impedes the hydrophobic collapse of partially unfolded proteins.

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Stumpe MC and Grubmüller H

Biophysical journal 96(9):3744-52, 2009 May 6 - Who cited this? | PubMed ID: 19413980 | Fulltext

Mechanical properties of the icosahedral shell of southern bean mosaic virus: a molecular dynamics study.

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Zink M and Grubmüller H

Biophysical journal 96(4):1350-63, 2009 Feb - Who cited this? | PubMed ID: 19217853 | Fulltext

Dynamics and energetics of permeation through aquaporins. What do we learn from molecular dynamics simulations?.

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Hub JS, Grubmüller H, and de Groot BL

Handbook of experimental pharmacology(190):57-76, 2009 - Who cited this? | PubMed ID: 19096772 | Fulltext

Ultrafast phase transitions in metastable water near liquid interfaces.

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Link O, Vöhringer-Martinez E, Lugovoj E, Liu Y, Siefermann K, Faubel M, Grubmüller H, Gerber RB, Miller Y, and Abel B

Faraday discussions 141:67-79; discussion 81-98, 2009 - Who cited this? | PubMed ID: 19227352 | Fulltext

Residual dipolar couplings as a tool to study molecular recognition of ubiquitin.

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Lakomek NA, Lange OF, Walter KF, Farès C, Egger D, Lunkenheimer P, Meiler J, Grubmüller H, Becker S, de Groot BL, and Griesinger C

Biochemical Society transactions 36(Pt 6):1433-7, 2008 Dec - Who cited this? | PubMed ID: 19021570 | Fulltext

Single-molecule FRET measures bends and kinks in DNA.

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Wozniak AK, Schröder GF, Grubmüller H, Seidel CA, and Oesterhelt F

Proceedings of the National Academy of Sciences of the United States of America 105(47):18337-42, 2008 Nov 25 - Who cited this? | PubMed ID: 19020079 | Fulltext

Polar or apolar-the role of polarity for urea-induced protein denaturation.

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Stumpe MC and Grubmüller H

PLoS computational biology 4(11):e1000221, 2008 Nov - Who cited this? | PubMed ID: 19008937 | Fulltext

Mechanoenzymatics of titin kinase.

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Puchner EM, Alexandrovich A, Kho AL, Hensen U, Schäfer LV, Brandmeier B, Gräter F, Grubmüller H, Gaub HE, and Gautel M

Proceedings of the National Academy of Sciences of the United States of America, 2008 Sep 2 - Who cited this? | PubMed ID: 18765796 | Fulltext

Accuracy and convergence of free energy differences calculated from nonequilibrium switching processes.

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Goette M and Grubmüller H

Journal of computational chemistry, 2008 Aug 1 - Who cited this? | PubMed ID: 18677708 | Fulltext

Self-consistent residual dipolar coupling based model-free analysis for the robust determination of nanosecond to microsecond protein dynamics.

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Lakomek NA, Walter KF, Farès C, Lange OF, de Groot BL, Grubmüller H, Brüschweiler R, Munk A, Becker S, Meiler J, and Griesinger C

Journal of biomolecular NMR 41(3):139-55, 2008 Jul - Who cited this? | PubMed ID: 18523727 | Fulltext

Is TEA an inhibitor for human Aquaporin-1?.

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Müller EM, Hub JS, Grubmüller H, and de Groot BL

Pflugers Archiv : European journal of physiology 456(4):663-9, 2008 Jul - Who cited this? | PubMed ID: 18196268 | Fulltext

Recognition dynamics up to microseconds revealed from an RDC-derived ubiquitin ensemble in solution.

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Lange OF, Lakomek NA, Farès C, Schröder GF, Walter KF, Becker S, Meiler J, Grubmüller H, Griesinger C, and de Groot BL

Science (New York, N.Y.) 320(5882):1471, 2008 Jun 13 - Who cited this? | PubMed ID: 18556554 | Fulltext

Importin-beta: Structural and Dynamic Determinants of a Molecular Spring.

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Zachariae U and Grubmüller H

Structure (London, England : 1993) 16(6):906, 2008 Jun - Who cited this? | PubMed ID: 18547523 | Fulltext

Kinetics, Statistics, and Energetics of Lipid Membrane Electroporation Studied by Molecular Dynamics Simulations.

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Böckmann RA, de Groot BL, Kakorin S, Neumann E, and Grubmüller H

Biophysical journal, 2008 May 9 - Who cited this? | PubMed ID: 18469089 | Fulltext

Arginine52 controls the photoisomerization process in photoactive yellow protein.

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Groenhof G, Schäfer LV, Boggio-Pasqua M, Grubmüller H, and Robb MA

Journal of the American Chemical Society 130(11):3250-1, 2008 Mar 19 - Who cited this? | PubMed ID: 18293978 | Fulltext

Full correlation analysis of conformational protein dynamics.

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Lange OF and Grubmüller H

Proteins 70(4):1294-312, 2008 Mar - Who cited this? | PubMed ID: 17876828 | Fulltext

Chromophore Protonation State Controls Photoswitching of the Fluoroprotein asFP595.

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Schäfer LV, Groenhof G, Boggio-Pasqua M, Robb MA, and Grubmüller H

PLoS computational biology 4(3):e1000034, 2008 Mar - Who cited this? | PubMed ID: 18369426 | Fulltext

Folding and assembly of proteorhodopsin.

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Klyszejko AL, Shastri S, Mari SA, Grubmüller H, Muller DJ, and Glaubitz C

Journal of molecular biology 376(1):35, 2008 Feb 8 - Who cited this? | PubMed ID: 18155728 | Fulltext

Interaction of urea with amino acids: implications for urea-induced protein denaturation.

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Stumpe MC and Grubmüller H

Journal of the American Chemical Society 129(51):16126, 2007 Dec 26 - Who cited this? | PubMed ID: 18047342 | Fulltext

Ultrafast deactivation channel for thymine dimerization.

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Boggio-Pasqua M, Groenhof G, Schäfer LV, Grubmüller H, and Robb MA

Journal of the American Chemical Society 129(36):10996-7, 2007 Sep 12 - Who cited this? | PubMed ID: 17696541 | Fulltext

Speeding up parallel GROMACS on high-latency networks.

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Kutzner C, van der Spoel D, Fechner M, Lindahl E, Schmitt UW, de Groot BL, and Grubmüller H

Journal of computational chemistry 28(12):2075-84, 2007 Sep - Who cited this? | PubMed ID: 17405124 | Fulltext

Anatomy and dynamics of a supramolecular membrane protein cluster.

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Sieber JJ, Willig KI, Kutzner C, Gerding-Reimers C, Harke B, Donnert G, Rammner B, Eggeling C, Hell SW, Grubmüller H, and Lang T

Science (New York, N.Y.) 317(5841):1072, 2007 Aug 24 - Who cited this? | PubMed ID: 17717182 | Fulltext

A molecular dynamics study of slow base flipping in DNA using conformational flooding.

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Bouvier B and Grubmüller H

Biophysical journal 93(3):770-86, 2007 Aug 1 - Who cited this? | PubMed ID: 17496048 | Fulltext

Aqueous urea solutions: structure, energetics, and urea aggregation.

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Stumpe MC and Grubmüller H

The journal of physical chemistry. B 111(22):6220, 2007 Jun 7 - Who cited this? | PubMed ID: 17497766 | Fulltext

Ultrafast deactivation of an excited cytosine-guanine base pair in DNA.

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Groenhof G, Schäfer LV, Boggio-Pasqua M, Goette M, Grubmüller H, and Robb MA

Journal of the American Chemical Society 129(21):6812-9, 2007 May 30 - Who cited this? | PubMed ID: 17488008 | Fulltext

Fluctuations of primary ubiquitin folding intermediates in a force clamp.

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Gräter F and Grubmüller H

Journal of structural biology 157(3):557-69, 2007 Mar - Who cited this? | PubMed ID: 17306561 | Fulltext

Estimation of absolute solvent and solvation shell entropies via permutation reduction.

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Reinhard F and Grubmüller H

The Journal of chemical physics 126(1):014102, 2007 Jan 7 - Who cited this? | PubMed ID: 17212485 | Fulltext

Photoswitching of the fluorescent protein asFP595: mechanism, proton pathways, and absorption spectra.

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Schäfer LV, Groenhof G, Klingen AR, Ullmann GM, Boggio-Pasqua M, Robb MA, and Grubmüller H

Angewandte Chemie (International ed. in English) 46(4):530-6, 2007 - Who cited this? | PubMed ID: 17094157 | Fulltext

Elastic properties of photoswitchable azobenzene polymers from molecular dynamics simulations.

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Schäfer LV, Müller EM, Gaub HE, and Grubmüller H

Angewandte Chemie (International ed. in English) 46(13):2232-7, 2007 - Who cited this? | PubMed ID: 17300120 | Fulltext

Molecular anatomy of a trafficking organelle.

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Takamori S, Holt M, Stenius K, Lemke EA, Grønborg M, Riedel D, Urlaub H, Schenck S, Brügger B, Ringler P, Müller SA, Rammner B, Gräter F, Hub JS, de Groot BL, Mieskes G,

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Cell 127(4):831, 2006 Nov 17 - Who cited this? | PubMed ID: 17110340 | Fulltext

Can principal components yield a dimension reduced description of protein dynamics on long time scales?.

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Lange OF and Grubmüller H

The journal of physical chemistry. B 110(45):22842-52, 2006 Nov 16 - Who cited this? | PubMed ID: 17092036 | Fulltext

Flooding in GROMACS: accelerated barrier crossings in molecular dynamics.

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Lange OF, Schäfer LV, and Grubmüller H

Journal of computational chemistry 27(14):1693-702, 2006 Nov 15 - Who cited this? | PubMed ID: 16900489 | Fulltext

Ligand-release pathways in the pheromone-binding protein of Bombyx mori.

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Gräter F, de Groot BL, Jiang H, and Grubmüller H

Structure (London, England : 1993) 14(10):1567-76, 2006 Oct - Who cited this? | PubMed ID: 17027505 | Fulltext

Pheromone discrimination by the pheromone-binding protein of Bombyx mori.

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Gräter F, Xu W, Leal W, and Grubmüller H

Structure (London, England : 1993) 14(10):1577-86, 2006 Oct - Who cited this? | PubMed ID: 17027506 | Fulltext

A highly strained nuclear conformation of the exportin Cse1p revealed by molecular dynamics simulations.

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Zachariae U and Grubmüller H

Structure (London, England : 1993) 14(9):1469, 2006 Sep - Who cited this? | PubMed ID: 16962977 | Fulltext

Collective Langevin dynamics of conformational motions in proteins.

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Lange OF and Grubmüller H

The Journal of chemical physics 124(21):214903, 2006 Jun 7 - Who cited this? | PubMed ID: 16774438 | Fulltext

Quaternary ammonium compounds as water channel blockers. Specificity, potency, and site of action.

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Detmers FJ, de Groot BL, Müller EM, Hinton A, Konings IB, Sze M, Flitsch SL, Grubmüller H, and Deen PM

The Journal of biological chemistry 281(20):14207-14, 2006 May 19 - Who cited this? | PubMed ID: 16551622 | Fulltext

Sequential N- to C-terminal SNARE complex assembly drives priming and fusion of secretory vesicles.

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Sørensen JB, Wiederhold K, Müller EM, Milosevic I, Nagy G, de Groot BL, Grubmüller H, and Fasshauer D

The EMBO journal 25(5):955-66, 2006 Mar 8 - Who cited this? | PubMed ID: 16498411 | Fulltext

Generalized correlation for biomolecular dynamics.

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Lange OF and Grubmüller H

Proteins 62(4):1053-61, 2006 Mar 1 - Who cited this? | PubMed ID: 16355416 | Fulltext

Simulation of fluorescence anisotropy experiments: probing protein dynamics.

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Schröder GF, Alexiev U, and Grubmüller H

Biophysical journal 89(6):3757-70, 2005 Dec - Who cited this? | PubMed ID: 16169987 | Fulltext

Detecting protein-induced folding of the U4 snRNA kink-turn by single-molecule multiparameter FRET measurements.

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Woźniak AK, Nottrott S, Kühn-Hölsken E, Schröder GF, Grubmüller H, Lührmann R, Seidel CA, and Oesterhelt F

RNA (New York, N.Y.) 11(10):1545-54, 2005 Oct - Who cited this? | PubMed ID: 16199764 | Fulltext

Structure and mechanism of the reversible photoswitch of a fluorescent protein.

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Andresen M, Wahl MC, Stiel AC, Gräter F, Schäfer LV, Trowitzsch S, Weber G, Eggeling C, Grubmüller H, Hell SW, and Jakobs S

Proceedings of the National Academy of Sciences of the United States of America 102(37):13070-4, 2005 Sep 13 - Who cited this? | PubMed ID: 16135569 | Fulltext

Probing conformational disorder in neurotensin by two-dimensional solid-state NMR and comparison to molecular dynamics simulations.

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Heise H, Luca S, de Groot BL, Grubmüller H, and Baldus M

Biophysical journal 89(3):2113-20, 2005 Sep - Who cited this? | PubMed ID: 15994900 | Fulltext

Molecular dynamics simulations of protein G challenge NMR-derived correlated backbone motions.

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Lange OF, Grubmüller H, and de Groot BL

Angewandte Chemie (International ed. in English) 44(22):3394-9, 2005 May 30 - Who cited this? | PubMed ID: 15912573 | Fulltext

The dynamics and energetics of water permeation and proton exclusion in aquaporins.

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de Groot BL and Grubmüller H

Current opinion in structural biology 15(2):176-83, 2005 Apr - Who cited this? | PubMed ID: 15837176 | Fulltext

Mechanically induced titin kinase activation studied by force-probe molecular dynamics simulations.

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Gräter F, Shen J, Jiang H, Gautel M, and Grubmüller H

Biophysical journal 88(2):790-804, 2005 Feb - Who cited this? | PubMed ID: 15531631 | Fulltext

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Papers authored by Grubmüller H

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