Neural Network Based Prediction of Conformational Free Energies - A New Route toward Coarse-Grained Simulation Models von Lemke, Tobias, Peter, Christine

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Three Reasons Why Aspartic Acid and Glutamic Acid Sequences Have a Surprisingly Different Influence on Mineralization von Lemke, Tobias, Edte, Moritz, Gebauer, Denis, Peter, Christine

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Evaluation and Optimization of Interface Force Fields for Water on Gold Surfaces von Berg, Andrej, Peter, Christine, Johnston, Karen

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Combining molecular dynamics simulations and scoring method to computationally model ubiquitylated linker histones in chromatosomes von Sawade, Kevin, Marx, Andreas, Peter, Christine, Kukharenko, Oleksandra

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Computer Simulations of Soft Matter: Linking the Scales von Potestio, Raffaello, Peter, Christine, Kremer, Kurt

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Towards a molecular basis of ubiquitin signaling: A dual-scale simulation study of ubiquitin dimers von Berg, Andrej, Kukharenko, Oleksandra, Scheffner, Martin, Peter, Christine

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Tipping the Scale from Disorder to Alpha-helix: Folding of Amphiphilic Peptides in the Presence of Macroscopic and Molecular Interfaces von Dalgicdir, Cahit, Globisch, Christoph, Peter, Christine, Sayar, Mehmet

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Ion Transport through Membrane-Spanning Nanopores Studied by Molecular Dynamics Simulations and Continuum Electrostatics Calculations von Peter, Christine, Hummer, Gerhard

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Optimization of an elastic network augmented coarse grained model to study CCMV capsid deformation von Globisch, Christoph, Krishnamani, Venkatramanan, Deserno, Markus, Peter, Christine

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A Ligand Selection Strategy Identifies Chemical Probes Targeting the Proteases of SARS‐CoV‐2 von Peñalver, Lilian, Schmid, Philipp, Szamosvári, Dávid, Schildknecht, Stefan, Globisch, Christoph, Sawade, Kevin, Peter, Christine, Böttcher, Thomas

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Structure-based coarse-graining in liquid slabs von Jochum, Mara, Andrienko, Denis, Kremer, Kurt, Peter, Christine

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Lipid-mediated activation of plasma membrane-localized deubiquitylating enzymes modulate endosomal trafficking von Vogel, Karin, Bläske, Tobias, Nagel, Marie-Kristin, Globisch, Christoph, Maguire, Shane, Mattes, Lorenz, Gude, Christian, Kovermann, Michael, Hauser, Karin, Peter, Christine, Isono, Erika

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EncoderMap: Dimensionality Reduction and Generation of Molecule Conformations von Lemke, Tobias, Peter, Christine

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Electrostatic and steric effects underlie acetylation-induced changes in ubiquitin structure and function von Kienle, Simon Maria, Schneider, Tobias, Stuber, Katrin, Globisch, Christoph, Jansen, Jasmin, Stengel, Florian, Peter, Christine, Marx, Andreas, Kovermann, Michael, Scheffner, Martin

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Derivation of Coarse Grained Models for Multiscale Simulation of Liquid Crystalline Phase Transitions von Mukherjee, Biswaroop, Delle Site, Luigi, Kremer, Kurt, Peter, Christine

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Generating a conformational landscape of ubiquitin chains at atomistic resolution by back-mapping based sampling von Hunkler, Simon, Buhl, Teresa, Kukharenko, Oleksandra, Peter, Christine

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Deciphering molecular details of the RAC–ribosome interaction by EPR spectroscopy von Fries, Sandra J., Braun, Theresa S., Globisch, Christoph, Peter, Christine, Drescher, Malte, Deuerling, Elke

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The structure of the ubiquitin-like modifier FAT10 reveals an alternative targeting mechanism for proteasomal degradation von Aichem, Annette, Anders, Samira, Catone, Nicola, Rößler, Philip, Stotz, Sophie, Berg, Andrej, Schwab, Ricarda, Scheuermann, Sophia, Bialas, Johanna, Schütz-Stoffregen, Mira C., Schmidtke, Gunter, Peter, Christine, Groettrup, Marcus, Wiesner, Silke

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The GROMOS software for biomolecular simulation: GROMOS05 von Christen, Markus, Hünenberger, Philippe H., Bakowies, Dirk, Baron, Riccardo, Bürgi, Roland, Geerke, Daan P., Heinz, Tim N., Kastenholz, Mika A., Kräutler, Vincent, Oostenbrink, Chris, Peter, Christine, Trzesniak, Daniel, van Gunsteren, Wilfred F.

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Understanding the Control of Mineralization by Polyelectrolyte Additives: Simulation of Preferential Binding to Calcite Surfaces von Shen, Jia-Wei, Li, Chunli, van der Vegt, Nico F. A., Peter, Christine

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