Bergel, A. ; Bhatale, A. ; Boehme, D. ; Gralka, P. ; Griffin, K. ; Hermanns, M.-A. ; Okanović, D. ; Pearce, O. ; u. a.: Visual Analytics Challenges in Analyzing Calling Context Trees. In: 5th International Workshop on Visual Performance Analysis, 5th International Workshop on Visual Performance Analysis. (2018)
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Cooper, April M. ; Hallmen, Philipp P. ; Kästner, Johannes: Potential energy surface interpolation with neural networks for instanton rate calculations. In: The Journal of Chemical Physics, The Journal of Chemical Physics. Bd. 148 (2018), Nr. 094106
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Cruz-Leon, Sergio ; Vazquez-Mayagoitia, Alvaro ; Melchionna, Simone ; Schwierz, Nadine ; Fyta, Maria: Coarse-Grained Double-Stranded RNA Model from Quantum-Mechanical Calculations. In: The Journal of Physical Chemistry B, The Journal of Physical Chemistry B. Bd. 122 (2018), Nr. 32, S. 7915--7928
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Eisfeld, Eugen ; Roth, Johannes: Atomistic simulations of ultra-short pulse laser ablation of aluminum: validity of the Lambert-Beer law. In: Pfeffer, M. (Hrsg.) Advanced Optical Technologies, Advanced Optical Technologies. Bd. 7 (2018), Nr. 3, S. 189–196
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Ferrario, V. ; Pleiss, J.: Simulation of protein diffusion: a sensitive probe of protein-solvent interactions. In: Journal of Biomolecular Structure and Dynamics, Journal of Biomolecular Structure and Dynamics. (2018)
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Ferrario, Valerio ; Hansen, Niels ; Pleiss, Jürgen: Interpretation of cytochrome P450 monooxygenase kinetics by modeling of thermodynamic activity. In: Journal of Inorganic Biochemistry, Journal of Inorganic Biochemistry. Bd. 183 (2018)
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Hirschmann, S. ; Lahnert, M. ; Schober, C. ; Brunn, M. ; Mehl, M. ; Pflüger, D.: Load-Balancing and Spatial Adaptivity for Coarse-Grained Molecular Dynamics Applications. In: High Performance Computing in Science and Engineering, High Performance Computing in Science and Engineering. Bd. 18, Springer (2018a)
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Hirschmann, Steffen ; Glass, Colin W. ; Pflüger, Dirk: Load-balancing and Hybrid Parallelization for Simulations with Large Particle Numbers (Lightning Talk). In: IXPUG Middle East Conference 2018 at KAUST, Thuwal, Saudi Arabia, IXPUG Middle East Conference 2018 at KAUST, Thuwal, Saudi Arabia. (2018b)
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Ibrahim, Mohamed ; Wickenhäuser, Patrick ; Rautek, Peter ; Reina, Guido ; Hadwiger, Markus: Screen-Space Normal Distribution Function Caching for Consistent Multi-Resolution Rendering of Large Particle Data. In: IEEE Transactions on Visualization and Computer Graphics, IEEE Transactions on Visualization and Computer Graphics. Bd. 24 (2018), Nr. 1, S. 944–953
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Miao, Haichao ; Klein, Tobias ; Kouřil, David ; Mindek, Peter ; Schatz, Karsten ; Gröller, M. Eduard ; Kozlíková, Barbora ; Isenberg, Tobias ; u. a.: Multiscale Molecular Visualization. In: Wright, P. (Hrsg.) Journal of Molecular Biology, Journal of Molecular Biology. Bd. 431 (2019), Nr. 6, S. 1049–1070
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Mwalongo, Finian ; Krone, Michael ; Reina, Guido ; Ertl, Thomas: Web-based Volume Rendering using Progressive Importance-based Data Transfer. In: Proceedings of Vision, Modeling, and Visualization (VMV), Proceedings of Vision, Modeling, and Visualization (VMV), 2018
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Müller, Christoph ; Krone, Michael ; Huber, Markus ; Biener, Verena ; Herr, Dominik ; Koch, Steffen ; Reina, Guido ; Weiskopf, Daniel ; u. a.: Interactive Molecular Graphics for Augmented Reality Using HoloLens. In: Schreiber, F. ; Hofestädt, R. (Hrsg.) Journal of Integrative Bioinformatics, Journal of Integrative Bioinformatics. Bd. 15 (2018), Nr. 2
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Oprzeska-Zingrebe, E. A. ; Smiatek, J.: Preferential binding of urea to single-stranded DNA structures: a molecular dynamics study. In: Biophysical Journal, Biophysical Journal. Bd. 10 (2018a), Nr. 114 (7), S. 1551–1562
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Oprzeska-Zingrebe, Ewa Anna ; Smiatek, Jens: Aqueous ionic liquids in comparison with standard co-solutes - differences and common principles in their interaction with protein and DNA structures. In: Biophysical Reviews, Biophysical Reviews. Bd. 10 (2018b), Nr. 3, S. 809–824
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Sadeghi, R. ; Shadloo, M. S. ; Hopp-Hirschler, M. ; Hadjadj, A. ; Nieken, U.: Three-dimensional lattice Boltzmann simulations of high density ratio two-phase flows in porous media. In: Computers and Mathematics with Applications, Computers and Mathematics with Applications. (2018)
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Sarap, C. S. ; Partov-Azar, P. ; Fyta, M.: Optoelectronic properties of diamondoid-DNA complexes. In: ACS Applied Bio Materials, ACS Applied Bio Materials. Bd. 1 (2018a), Nr. 1, S. 59–69
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Sarap, C.S. ; Adhikari, B. ; Meng, S. ; Uhlig, F. ; Fyta, M.: Optical Properties of Single- and Double-Functionalized Small Diamondoids. In: The Journal of Physical Chemistry A, The Journal of Physical Chemistry A. Bd. 2018 122 (2018b), Nr. 14, S. 3583–3593
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Schulz, Christoph ; Schatz, Karsten ; Krone, Michael ; Braun, Matthias ; Ertl, Thomas ; Weiskopf, Daniel: Uncertainty Visualization for Secondary Structures of Proteins. In: IEEE Pacific Visualization Symposium, IEEE Pacific Visualization Symposium, 2018, S. 96–105
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Zander, C. ; Hopp-Hirschler, M. ; Nieken, U.: Mesoscopic simulation and characterization of the morphological evolution in phase separating fluid mixtures. In: Computational Material Science, Computational Material Science. (2018), Nr. 149, S. 267–281
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Zhou, Liang ; Weiskopf, Daniel: Contrast Enhancement Based on Viewing Distance. In: Proceedings of the 11th International Symposium on Visual Information Communication and Interaction (VINCI 18, Best Paper Award), Proceedings of the 11th International Symposium on Visual Information Communication and Interaction (VINCI 18, Best Paper Award). Sweden : ACM, 2018 — ISBN 978-1-4503-6501-7, S. 25--32
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