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Poma, A. B.; Guzman, H. V.; Li, M.; Theodorakis, P. E.: Mechanical and thermodynamic properties of Aβ42, Aβ40, and α-synuclein fibrils: A coarse-grained method to complement experimental studies. Beilstein Journal of Nanotechnology 10, S. 500 - 513 (2019)
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Poma, A. B.; Vargas-Guzman, H.; Li, M. S.; Theodorakis, P. E.: Mechanical and thermodynamic properties of A beta(42), A beta(40), and alpha-synuclein fibrils: a coarse-grained method to complement experimental studies. Beilstein Journal of Nanotechnology 10, S. 500 - 513 (2019)
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Potisk, T.; Pleiner, H.; Brand, H. R.: Influence of tetrahedral order on ferromagnetic gel phases. European Physical Journal E 42 (3), 35 (2019)
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Potisk, T.; Svenšek, D.; Pleiner, H.; Brand, H. R.: Continuum model of magnetic field induced viscoelasticity in magnetorheological fluids. The Journal of Chemical Physics 150 (17), 174901 (2019)
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Rudzinski, J. F.: Recent Progress towards Chemically-Specific Coarse-Grained Simulation Models with Consistent Dynamical Properties. Computation 7 (3), 42 (2019)
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Rudzinski, J. F.; Radu, M.; Bereau, T.: Automated detection of many-particle solvation states for accurate characterizations of diffusion kinetics. The Journal of Chemical Physics 150 (2), 024102 (2019)
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Santra, A.; Kumari, K.; Padinhateeri, R.; Dünweg, B.; Prakash, J. R.: Universality of the collapse transition of sticky polymers. Soft Matter 15 (39), S. 7876 - 7887 (2019)
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Scherer, C.; Schmid, F.; Letz, M.; Horbach, J.: Structure and dynamics of B2O3 melts and glasses: From ab initio to classical molecular dynamics simulations. Computational Materials Science 159, S. 73 - 85 (2019)
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Schilling, C.; Mack, T.; Lickfett, S.; Sieste, S.; Ruggeri, F. S.; Šneideris, T.; Dutta, A.; Bereau, T.; Naraghi, R.; Sinske, D. et al.; Knowles, T. P. J.; Synatschke, C. V.; Weil, T.; Knöll, B.: Sequence-Optimized Peptide Nanofibers as Growth Stimulators for Regeneration of Peripheral Neurons. Advanced Functional Materials 29 (24), 1809112 (2019)
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Schott, S.; Chopra, U.; Lemaur, V.; Melnyk, A.; Olivier, Y.; Di Pietro, R.; Romanov, I.; Carey, R. L.; Jiao, X.; Jellett, C. et al.; Little, M.; Marks, A.; McNeill, C. R.; McCulloch, I.; McNellis, E. R.; Andrienko, D.; Beljonne, D.; Sinova, J.; Sirringhaus, H.: Polaron spin dynamics in high-mobility polymeric semiconductors. Nature Physics 15, S. 814 - 822 (2019)
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Schwarze, M.; Schellhammer, K. S.; Ortstein, K.; Benduhn, J.; Gaul, C.; Hinderhofer, A.; Toro, L. P.; Scholz, R.; Kublitski, J.; Roland, S. et al.; Lau, M.; Poelking, C.; Andrienko, D.; Cuniberti, G.; Schreiber, F.; Neher, D.; Vandewal, K.; Ortmann, F.; Leo, K.: Impact of molecular quadrupole moments on the energy levels at organic heterojunctions. Nature Communications 10, 2466 (2019)
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Smrek, J.; Kremer, K.; Rosa, A.: Threading of Unconcatenated Ring Polymers at High Concentrations: Double-Folded vs Time-Equilibrated Structures. ACS Macro Letters 8 (2), S. 155 - 160 (2019)
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Strasser, P. J.; Tierra, G.; Dünweg, B.; Lukacova-Medvid'ova, M.: Energy-stable linear schemes for polymer-solvent phase field models. Computers & Mathematics with Applications 77, S. 125 - 143 (2019)
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Svenšek, D.; Pleiner, H.; Brand, H. R.: A dynamic preferred direction model for the self-organization dynamics of bacterial microfluidic pumping. Soft Matter 15 (9), S. 2032 - 2042 (2019)
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Tabujew, I.; Heidari, M.; Freidel, C.; Helm, M.; Tebbe, L.; Wolfrum, U.; Nagel-Wolfrum, K.; Koynov, K.; Biehl, P.; Schacher, F. H. et al.; Potestio, R.; Peneva, K.: Tackling the Limitations of Copolymeric Small Interfering RNA Delivery Agents by a Combined Experimental-Computational Approach. Biomacromolecules 20 (12), S. 4389 - 4406 (2019)
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Wörner, S. J.; Bereau, T.; Kremer, K.; Rudzinski, J. F.: Direct route to reproducing pair distribution functions with coarse-grained models via transformed atomistic cross correlations. The Journal of Chemical Physics 151 (24), 244110 (2019)
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Ye, S.; Janasz, L.; Zajaczkowski, W.; Manion, J. G.; Mondal, A.; Marszalek, T.; Andrienko, D.; Müllen, K.; Pisula, W.; Seferos, D. S.: Self-Organization and Charge Transport Properties of Selenium and Tellurium Analogues of Polythiophene. Macromolecular Rapid Communications 40 (1), 1800596 (2019)
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59.
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Bereau, T.: High-throughput molecular dynamics of drug-membrane thermodynamics. In Abstracts of Papers of the American Chemical Society, 258, 105-COMP. ACS Fall National Meeting and Exposition, San Diego, CA, 25. August 2019 - 29. August 2019. (2019)
60.
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Donadio, D.; Bononi, F.; Kling, T.; Huller, T.; Anastasio, C.: Aromatic molecules at ice surfaces: solvation and light absorption. In Abstracts of Papers of the American Chemical Society, 257, 632. National Meeting of the American-Chemical-Society (ACS), Orlando, FL, USA, 31. März 2019 - 04. April 2019. ACS, Washington DC, USA (2019)
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