Biography of Klaus Schulten (Englisch)
- Neue Suche nach: Amaro, Rommie E.
- Weitere Informationen zu Amaro, Rommie E.:
- https://orcid.org/0000-0002-9275-9553
- Neue Suche nach: Villa, Elizabeth
- Neue Suche nach: Luthey-Schulten, Zan
- Neue Suche nach: Amaro, Rommie E.
- Weitere Informationen zu Amaro, Rommie E.:
- https://orcid.org/0000-0002-9275-9553
- Neue Suche nach: Villa, Elizabeth
- Neue Suche nach: Luthey-Schulten, Zan
In:
The Journal of Physical Chemistry B
;
121
, 15
;
3206
;
2017
- Aufsatz (Zeitschrift) / Elektronische Ressource
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Titel:Biography of Klaus Schulten
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Weitere Titelangaben:J. Phys. Chem. B
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Beteiligte:
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Erschienen in:The Journal of Physical Chemistry B ; 121, 15 ; 3206
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Verlag:
- Neue Suche nach: American Chemical Society
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Erscheinungsdatum:20.04.2017
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ISSN:
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Coden:
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DOI:
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Medientyp:Aufsatz (Zeitschrift)
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Format:Elektronische Ressource
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Sprache:Englisch
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Datenquelle:
Inhaltsverzeichnis – Band 121, Ausgabe 15
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Die Inhaltsverzeichnisse werden automatisch erzeugt und basieren auf den im Index des TIB-Portals verfügbaren Einzelnachweisen der enthaltenen Beiträge. Die Anzeige der Inhaltsverzeichnisse kann daher unvollständig oder lückenhaft sein.
- 3203
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Tribute to Klaus SchultenTajkhorshid, Emad / Chipot, Christophe et al. | 2017
- 3206
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Biography of Klaus SchultenAmaro, Rommie E. / Villa, Elizabeth / Luthey-Schulten, Zan et al. | 2017
- 3207
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Colleagues of Klaus SchultenSchulten, Klaus et al. | 2017
- 3209
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Abbreviated Curriculum Vitae of Klaus SchultenSchulten, Klaus et al. | 2017
- 3210
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Selected Publications of Klaus SchultenSchulten, Klaus et al. | 2017
- 3228
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Protein Arrangement Effects on the Exciton Dynamics in the PE555 ComplexChandrasekaran, Suryanarayanan / Pothula, Karunakar Reddy / Kleinekathöfer, Ulrich et al. | 2017
- 3237
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Molecular Dynamics of Photosystem II Embedded in the Thylakoid Membranevan Eerden, Floris J. / van den Berg, Tom / Frederix, Pim W. J. M. / de Jong, Djurre H. / Periole, Xavier / Marrink, Siewert J. et al. | 2017
- 3250
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Primary Fibril Nucleation of Aggregation Prone Tau Fragments PHF6 and PHF6*Smit, Florent X. / Luiken, Jurriaan A. / Bolhuis, Peter G. et al. | 2017
- 3262
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Ganglioside-Lipid and Ganglioside-Protein Interactions Revealed by Coarse-Grained and Atomistic Molecular Dynamics SimulationsGu, Ruo-Xu / Ingólfsson, Helgi I. / de Vries, Alex H. / Marrink, Siewert J. / Tieleman, D. Peter et al. | 2017
- 3276
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Eliminating a Protein Folding Intermediate by Tuning a Local Hydrophobic ContactKachlishvili, Khatuna / Dave, Kapil / Gruebele, Martin / Scheraga, Harold A. / Maisuradze, Gia G. et al. | 2017
- 3285
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A Distal Disulfide Bridge in OXA‑1 β‑Lactamase Stabilizes the Catalytic Center and Alters the Dynamics of the Specificity Determining Ω LoopSimakov, Nikolay / Leonard, David A. / Smith, Jeremy C. / Wymore, Troy / Szarecka, Agnieszka et al. | 2017
- 3297
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Predicted Structures of the Proton-Bound Membrane-Embedded Rotor Rings of the Saccharomyces cerevisiae and Escherichia coli ATP SynthasesZhou, Wenchang / Leone, Vanessa / Krah, Alexander / Faraldo-Gómez, José D. et al. | 2017
- 3308
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Mutations at the Qo Site of the Cytochrome b c 1 Complex Strongly Affect Oxygen BindingHusen, Peter / Solov’yov, Ilia A. et al. | 2017
- 3318
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Origin of pK a Shifts of Internal Lysine Residues in SNase Studied Via Equal-Molar VMMS Simulations in Explicit WaterWu, Xiongwu / Lee, Juyong / Brooks, Bernard R. et al. | 2017
- 3331
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Dynamics of the Orientational Factor in Fluorescence Resonance Energy TransferHummer, Gerhard / Szabo, Attila et al. | 2017
- 3340
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Does Proton Conduction in the Voltage-Gated H+ Channel hHv1 Involve Grotthuss-Like Hopping via Acidic Residues?van Keulen, Siri C. / Gianti, Eleonora / Carnevale, Vincenzo / Klein, Michael L. / Rothlisberger, Ursula / Delemotte, Lucie et al. | 2017
- 3352
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The Activation of c‑Src Tyrosine Kinase: Conformational Transition Pathway and Free Energy LandscapeFajer, Mikolai / Meng, Yilin / Roux, Benoît et al. | 2017
- 3364
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Convergence and Sampling in Determining Free Energy Landscapes for Membrane Protein AssociationDomański, Jan / Hedger, George / Best, Robert B. / Stansfeld, Phillip J. / Sansom, Mark S. P. et al. | 2017
- 3376
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Finite Temperature String Method with Umbrella Sampling: Application on a Side Chain Flipping in Mhp1 TransporterSong, Hyun Deok / Zhu, Fangqiang et al. | 2017
- 3387
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Molecular Dynamics Analysis of 4E-BP2 Protein Fold Stabilization Induced by PhosphorylationBomblies, Rainer / Luitz, Manuel P. / Zacharias, Martin et al. | 2017
- 3394
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Estimation of Nanodiamond Surface Charge Density from Zeta Potential and Molecular Dynamics SimulationsGe, Zhenpeng / Wang, Yi et al. | 2017
- 3403
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Classical and Quantum Shortcuts to Adiabaticity in a Tilted PistonPatra, Ayoti / Jarzynski, Christopher et al. | 2017
- 3412
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Conformational Preference of Serogroup B Salmonella O Polysaccharide in Presence and Absence of the Monoclonal Antibody Se155–4Yang, Mingjun / Simon, Raphael / MacKerell, Alexander D. et al. | 2017
- 3424
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Direct Measurement of the Effect of Cholesterol and 6‑Ketocholestanol on the Membrane Dipole Electric Field Using Vibrational Stark Effect Spectroscopy Coupled with Molecular Dynamics SimulationsShrestha, Rebika / Anderson, Cari M. / Cardenas, Alfredo E. / Elber, Ron / Webb, Lauren J. et al. | 2017
- 3437
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Dependence of the Enzymatic Velocity on the Substrate Dissociation RateBerezhkovskii, Alexander M. / Szabo, Attila / Rotbart, T. / Urbakh, M. / Kolomeisky, Anatoly B. et al. | 2017
- 3443
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Lipid and Peptide Diffusion in Bilayers: The Saffman–Delbrück Model and Periodic Boundary ConditionsVenable, Richard M. / Ingólfsson, Helgi I. / Lerner, Michael G. / Perrin, B. Scott / Camley, Brian A. / Marrink, Siewert J. / Brown, Frank L. H. / Pastor, Richard W. et al. | 2017
- 3458
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Bayesian Model Averaging for Ensemble-Based Estimates of Solvation-Free EnergiesGosink, Luke J. / Overall, Christopher C. / Reehl, Sarah M. / Whitney, Paul D. / Mobley, David L. / Baker, Nathan A. et al. | 2017
- 3473
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Protein Folding and Structure Prediction from the Ground Up II: AAWSEM for α/β ProteinsChen, Mingchen / Lin, Xingcheng / Lu, Wei / Onuchic, José N. / Wolynes, Peter G. et al. | 2017
- 3483
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Local Mode Analysis: Decoding IR Spectra by Visualizing Molecular DetailsMassarczyk, M. / Rudack, T. / Schlitter, J. / Kuhne, J. / Kötting, C. / Gerwert, K. et al. | 2017
- 3493
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A Residue-Resolved Bayesian Approach to Quantitative Interpretation of Hydrogen–Deuterium Exchange from Mass Spectrometry: Application to Characterizing Protein–Ligand InteractionsSaltzberg, Daniel J. / Broughton, Howard B. / Pellarin, Riccardo / Chalmers, Michael J. / Espada, Alfonso / Dodge, Jeffrey A. / Pascal, Bruce D. / Griffin, Patrick R. / Humblet, Christine / Sali, Andrej et al. | 2017
- 3502
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Methodology for the Simulation of Molecular Motors at Different ScalesSingharoy, Abhishek / Chipot, Christophe et al. | 2017
- 3515
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Ripping RNA by Force Using Gaussian Network ModelsHyeon, Changbong / Thirumalai, D. et al. | 2017
- 3523
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Structural Insights How PIP2 Imposes Preferred Binding Orientations of FAK at Lipid MembranesHerzog, Florian A. / Braun, Lukas / Schoen, Ingmar / Vogel, Viola et al. | 2017
- 3536
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Redox-Driven Conformational Dynamics in a Photosystem-II-Inspired β‑Hairpin Maquette Determined through Spectroscopy and SimulationHwang, Hyea / McCaslin, Tyler G. / Hazel, Anthony / Pagba, Cynthia V. / Nevin, Christina M. / Pavlova, Anna / Barry, Bridgette A. / Gumbart, James C. et al. | 2017
- 3546
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Why Is There a Glass Ceiling for Threading Based Protein Structure Prediction Methods?Skolnick, Jeffrey / Zhou, Hongyi et al. | 2017
- 3555
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Nonpolar Solvation Free Energy from Proximal Distribution FunctionsOu, Shu-Ching / Drake, Justin A. / Pettitt, B. Montgomery et al. | 2017
- 3565
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Understanding the Phosphorylation Mechanism by Using Quantum Chemical Calculations and Molecular Dynamics SimulationsHan, Weiwei / Zhu, Jingxuan / Wang, Song / Xu, Dong et al. | 2017
- 3574
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Toward Closing the Gap: Quantum Mechanical Calculations and Experimentally Measured Chemical Shifts of a Microcrystalline LectinFritz, Matthew / Quinn, Caitlin M. / Wang, Mingzhang / Hou, Guangjin / Lu, Xingyu / Koharudin, Leonardus M. I. / Polenova, Tatyana / Gronenborn, Angela M. et al. | 2017
- 3586
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Molecular Details of the PH Domain of ACAP1BAR‑PH Protein Binding to PIP-Containing MembraneChan, Kevin Chun / Lu, Lanyuan / Sun, Fei / Fan, Jun et al. | 2017
- 3597
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SEEKR: Simulation Enabled Estimation of Kinetic Rates, A Computational Tool to Estimate Molecular Kinetics and Its Application to Trypsin–Benzamidine BindingVotapka, Lane W. / Jagger, Benjamin R. / Heyneman, Alexandra L. / Amaro, Rommie E. et al. | 2017
- 3607
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Validity of the Electrodiffusion Model for Calculating Conductance of Simple Ion ChannelsPohorille, Andrew / Wilson, Michael A. / Wei, Chenyu et al. | 2017
- 3620
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Mechanical Stability of a High-Affinity Toxin Anchor from the Pathogen Clostridium perfringensMilles, Lukas F. / Bayer, Edward A. / Nash, Michael A. / Gaub, Hermann E. et al. | 2017
- 3626
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Adaptive Landscape Flattening Accelerates Sampling of Alchemical Space in Multisite λ DynamicsHayes, Ryan L. / Armacost, Kira A. / Vilseck, Jonah Z. / Brooks, Charles L. et al. | 2017
- 3636
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The Multiple Roles of Waters in Protein SolvationHospital, Adam / Candotti, Michela / Gelpí, Josep Lluís / Orozco, Modesto et al. | 2017
- 3644
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What Can and Cannot Be Learned from Molecular Dynamics Simulations of Bacterial Proton-Coupled Oligopeptide Transporter GkPOT?Immadisetty, Kalyan / Hettige, Jeevapani / Moradi, Mahmoud et al. | 2017
- 3657
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Effect of Dimerization on the Dynamics of Neurotransmitter:Sodium SymportersGur, Mert / Cheng, Mary Hongying / Zomot, Elia / Bahar, Ivet et al. | 2017
- 3667
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Effects of Active Site Mutations on Specificity of Nucleobase Binding in Human DNA Polymerase ηUcisik, Melek N. / Hammes-Schiffer, Sharon et al. | 2017
- 3676
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Smoothed Biasing Forces Yield Unbiased Free Energies with the Extended-System Adaptive Biasing Force MethodLesage, Adrien / Lelièvre, Tony / Stoltz, Gabriel / Hénin, Jérôme et al. | 2017
- 3686
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Relation between Protein Intrinsic Normal Mode Weights and Pre-Existing Conformer PopulationsOzgur, Beytullah / Ozdemir, E. Sila / Gursoy, Attila / Keskin, Ozlem et al. | 2017
- 3701
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The Q‑Cycle Mechanism of the bc 1 Complex: A Biologist’s Perspective on Atomistic StudiesCrofts, Antony R. / Rose, Stuart W. / Burton, Rodney L. / Desai, Amit V. / Kenis, Paul J. A. / Dikanov, Sergei A. et al. | 2017
- 3718
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CHARMM-GUI MDFF/xMDFF Utilizer for Molecular Dynamics Flexible Fitting Simulations in Various EnvironmentsQi, Yifei / Lee, Jumin / Singharoy, Abhishek / McGreevy, Ryan / Schulten, Klaus / Im, Wonpil et al. | 2017
- 3724
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Modulation of Molecular Flux Using a Graphene Nanopore CapacitorShankla, Manish / Aksimentiev, Aleksei et al. | 2017
- 3734
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Equilibrium Denaturation and Preferential Interactions of an RNA Tetraloop with UreaMiner, Jacob C. / García, Angel E. et al. | 2017
- 3747
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Quantitative Characterization of Domain Motions in Molecular MachinesMaji, Suvrajit / Shahoei, Rezvan / Schulten, Klaus / Frank, Joachim et al. | 2017
- 3757
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Graphene Nanopores for Electronic Recognition of DNA MethylationSarathy, Aditya / Qiu, Hu / Leburton, Jean-Pierre et al. | 2017
- 3764
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Extension of the Highly Mobile Membrane Mimetic to Transmembrane Systems through Customized in Silico SolventsVermaas, Josh V. / Pogorelov, Taras V. / Tajkhorshid, Emad et al. | 2017
- 3777
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Nucleotide Selectivity at a Preinsertion Checkpoint of T7 RNA Polymerase Transcription ElongationE, Chao / Duan, Baogen / Yu, Jin et al. | 2017
- 3787
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Determination of Cell Doubling Times from the Return-on-Investment Time of Photosynthetic Vesicles Based on Atomic Detail Structural ModelsHitchcock, Andrew / Hunter, C. Neil / Sener, Melih et al. | 2017
- 3798
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Long-Range Dispersion Effects on the Water/Vapor Interface Simulated Using the Most Common ModelsSega, Marcello / Dellago, Christoph et al. | 2017
- 3804
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Atomistic Modeling of Ion Conduction through the Voltage-Sensing Domain of the Shaker K+ Ion ChannelWood, Mona L. / Freites, J. Alfredo / Tombola, Francesco / Tobias, Douglas J. et al. | 2017
- 3813
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Monod-Wyman-Changeux Analysis of Ligand-Gated Ion Channel MutantsEinav, Tal / Phillips, Rob et al. | 2017
- 3825
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Relationship between Solvation Thermodynamics from IST and DFT PerspectivesLevy, Ronald M. / Cui, Di / Zhang, Bin W. / Matubayasi, Nobuyuki et al. | 2017
- 3842
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Photoactivation Intermediates of a G‑Protein Coupled Receptor Rhodopsin Investigated by a Hybrid Molecular SimulationKamiya, Motoshi / Hayashi, Shigehiko et al. | 2017
- 3853
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CryoEM Structure Refinement by Integrating NMR Chemical Shifts with Molecular Dynamics SimulationsPerilla, Juan R. / Zhao, Gongpu / Lu, Manman / Ning, Jiying / Hou, Guangjin / Byeon, In-Ja L. / Gronenborn, Angela M. / Polenova, Tatyana / Zhang, Peijun et al. | 2017
- 3864
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1.14*CM1A-LBCC: Localized Bond-Charge Corrected CM1A Charges for Condensed-Phase SimulationsDodda, Leela S. / Vilseck, Jonah Z. / Tirado-Rives, Julian / Jorgensen, William L. et al. | 2017
- 3871
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Challenges of Integrating Stochastic Dynamics and Cryo-Electron Tomograms in Whole-Cell SimulationsEarnest, Tyler M. / Watanabe, Reika / Stone, John E. / Mahamid, Julia / Baumeister, Wolfgang / Villa, Elizabeth / Luthey-Schulten, Zaida et al. | 2017
- 3882
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Kilobase Pair Chromatin Fiber Contacts Promoted by Living-System-Like DNA Linker Length Distributions and Nucleosome DepletionBascom, Gavin D / Kim, Taejin / Schlick, Tamar et al. | 2017
- 3895
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Determinants of Alanine Dipeptide Conformational Equilibria on Graphene and Hydroxylated DerivativesPoblete, Horacio / Miranda-Carvajal, Ingrid / Comer, Jeffrey et al. | 2017