N-Glycosylation Enhances Conformational Flexibility of Protein Disulfide Isomerase Revealed by Microsecond Molecular Dynamics and Markov State Modeling von Weiß, R Gregor, Losfeld, Marie-Estelle, Aebi, Markus, Riniker, Sereina

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Confined Water Determines Transport Properties of Guest Molecules in Narrow Pores von Phan, Anh, Cole, David R, Weiß, R. Gregor, Dzubiella, Joachim, Striolo, Alberto

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Volume-scaled common nearest neighbor clustering algorithm with free-energy hierarchy von Weiß, R. Gregor, Ries, Benjamin, Wang, Shuzhe, Riniker, Sereina

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Connecting dynamic reweighting Algorithms: Derivation of the dynamic reweighting family tree von Linker, Stephanie M., Weiß, R. Gregor, Riniker, Sereina

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Curvature dependence of hydrophobic hydration dynamics von Weiß, R Gregor, Heyden, Matthias, Dzubiella, Joachim

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Variational implicit-solvent predictions of the dry–wet transition pathways for ligand–receptor binding and unbinding kinetics von Zhou, Shenggao, Weiß, R. Gregor, Cheng, Li-Tien, Dzubiella, Joachim, McCammon, J. Andrew, Li, Bo

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Relative free-energy calculations for scaffold hopping-type transformations with an automated RE-EDS sampling procedure von Ries, Benjamin, Normak, Karl, Weiß, R. Gregor, Rieder, Salomé, Barros, Emília P., Champion, Candide, König, Gerhard, Riniker, Sereina

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Evaluation of external stabilization of type II odontoid fractures in geriatric patients-An experimental study on a newly developed cadaveric trauma model von Jung, Matthias K, von Ehrlich-Treuenstätt, Gregor V R, Jung, Andreas L, Keil, Holger, Grützner, Paul A, Schneider, Niko R E, Kreinest, Michael

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Analysis of remaining motion using one innovative upper airway opening cervical collar and two traditional cervical collars von Jung, Matthias K., von Ehrlich-Treuenstätt, Gregor V. R., Keil, Holger, Grützner, Paul A., Schneider, Niko R. E., Kreinest, Michael

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Principles for Tuning Hydrophobic Ligand–Receptor Binding Kinetics von Weiß, R. Gregor, Setny, Piotr, Dzubiella, Joachim

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Solvent Fluctuations Induce Non-Markovian Kinetics in Hydrophobic Pocket-Ligand Binding von Weiß, R. Gregor, Setny, Piotr, Dzubiella, Joachim

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Affinity, kinetics, and pathways of anisotropic ligands binding to hydrophobic model pockets von Weiß, R. Gregor, Chudoba, Richard, Setny, Piotr, Dzubiella, Joachim

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One-Step Modulation Predictive Current Control Method for the Asymmetrical Dual Three-Phase Induction Machine von Barrero, F., Arahal, M.R., Gregor, R., Toral, S., Duran, M.J.

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Understanding superlinear speedup in current HPC architectures von Galeazzo, Flavio Cesar Cunha, Weiß, R. Gregor, Lesnik, Sergey, Rusche, Henrik, Ruopp, Andreas

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Altered brain network organization in adults with Asperger's syndrome: decreased connectome transitivity and assortativity with increased global efficiency von Javaheripour, Nooshin, Wagner, Gerd, de la Cruz, Feliberto, Walter, Martin, Szycik, Gregor R., Tietze, Fabian-Alexander

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Coherent mesh representation for parallel I/O of unstructured polyhedral meshes von Weiß, R. Gregor, Lesnik, Sergey, Galeazzo, Flavio C. C., Ruopp, Andreas, Rusche, Henrik

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A Proof of Concept Study of Predictive Current Control for VSI-Driven Asymmetrical Dual Three-Phase AC Machines von Barrero, F., Arahal, M.R., Gregor, R., Toral, S., Duran, M.J.

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The effect of multisensory semantic congruency on unisensory object recognition in schizophrenia von Ghaneirad, Erfan, Borgolte, Anna, Sinke, Christopher, Čuš, Anja, Bleich, Stefan, Szycik, Gregor R.

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Cognitive control in adults with high-functioning autism spectrum disorder: a study with event-related potentials von Möde, Laura, Borgolte, Anna, Ghaneirad, Erfan, Roy, Mandy, Sinke, Christopher, Szycik, Gregor R., Bleich, Stefan, Wiswede, Daniel

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Structural brain changes in young males addicted to video-gaming von Mohammadi, Bahram, Szycik, Gregor R., te Wildt, Bert, Heldmann, Marcus, Samii, Amir, Münte, Thomas F.

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