Gefördert durch die

 

2017

  1. Alharbi, Naif ; Alharbi, Mohammad ; Martinez, Xavier ; Krone, Michael ; Rose, Alexander ; Baaden, Marc ; Laramee, Robert S. ; Chavent, Matthieu: Molecular Visualization of Computational Biology Data: A Survey of Surveys. In: EuroVis 2017 Short Papers, EuroVis 2017 Short Papers, 2017
  2. Alvarez-Barcia, Sonia ; Kästner, Johannes: Atom Tunneling in the Hydroxylation Process of Taurine/alpha-Ketoglutarate Dioxygenase Identified by Quantum Mechanics/Molecular Mechanics Simulations. In: JOURNAL OF PHYSICAL CHEMISTRY B, JOURNAL OF PHYSICAL CHEMISTRY B. Bd. 121, AMER CHEMICAL SOC (2017), Nr. 21, S. 5347–5354
  3. Brunn, Malte ; Glass, Colin W. ; Lahnert, Michael ; Mehl, Miriam ; Pflüger, Dirk: Load balancing with p4est for Short-Range Molecular Dynamics with ESPResSo. In: Bassini, S. ; Danelutto, M. ; Dazzi, P. ; Joubert, G. R. ; Peters, F. ; Bassini, S. ; Danelutto, M. ; Dazzi, P. ; Joubert, G. R. ; Peters, F. (Hrsg.) ; Bassini, S. ; Danelutto, M. ; Dazzi, P. ; Joubert, G. R. ; Peters, F. (Hrsg.): Advances in Parallel Computing, Advances in Parallel Computing. Bd. Volume 32: Parallel Computing is Everywhere : IOS Press, 2017, S. 455–464
  4. Datar, Adwait V. ; Fyta, Maria ; Marconi, Umberto Marini Bettolo ; Melchionna, Simone: Electrokinetic Lattice Boltzmann Solver Coupled to Molecular Dynamics:    Application to Polymer Translocation. In: Langmuir, Langmuir. Bd. 33 (2017), Nr. 42, S. 11635–11645
  5. Gralka, Patrick ; Grottel, Sebastian ; Staib, Joachim ; Schatz, Karsten ; Karch, Grzegorz Karol ; Hirschler, M. ; Krone, Michael ; Reina, Guido ; u. a.: 2016 IEEE Scientific Visualization Contest Winner: Visual and Structural Analysis of Point-based Simulation Ensembles. In: IEEE Computer Graphics & Applications, IEEE Computer Graphics & Applications. (2017a)
  6. Gralka, Patrick ; Schulz, Christoph ; Reina, Guido ; Weiskopf, Daniel ; Ertl, Thomas: Visual Exploration of Memory Traces and Call Stacks. In: 2017 IEEE Working Conference on Software Visualization (VISSOFT), 2017 IEEE Working Conference on Software Visualization (VISSOFT) : IEEE, 2017b, S. 54–63
  7. Hermosilla, Pedro ; Krone, Michael ; Guallar, Victor ; Vázquez, Pere-Pau ; Vinacua, Àlvar ; Ropinski, Timo: Interactive GPU-based Generation of Solvent Excluded Surfaces. In: The Visual Computer (Proceedings of CGI’2017), The Visual Computer (Proceedings of CGI’2017). Bd. 33, Springer (2017), Nr. 6, S. 869–881
  8. Hirschler, Manuel ; Nieken, Ulrich: Study of implicit time-integration in truly incompressible SPH. In: Proceedings of the 12th International SPHERIC Workshop, 13.-15.06.2017, Ourense, Spain, Proceedings of the 12th International SPHERIC Workshop, 13.-15.06.2017, Ourense, Spain, 2017
  9. Hirschler, Manuel ; Oger, G. ; Nieken, Ulrich ; Le Touzé, D.: Modeling of droplet collisions using Smoothed Particle Hydrodynamics. In: International Journal of Multiphase Flow, International Journal of Multiphase Flow. Bd. 95 (2017)
  10. Hocker, Stephen ; Rapp, D. ; Schmauder, Siegfried: Molecular dynamics simulations of strengthening due to silver precipitates in copper matrix. In: Physica Status Solidi B, Physica Status Solidi B. Bd. 254 (2017), Nr. 5
  11. Hopp-Hirschler, Manuel: Modeling of porous polymer membrane formation, 2017
  12. Inci, G ; Kronenburg, A ; Weeber, R ; Pflüger, D: Langevin Dynamics Simulation of Transport and Aggregation of Soot Nano-particles in Turbulent Flows. In: Flow, Turbulence and Combustion, Flow, Turbulence and Combustion., Springer (2017), S. 1--21
  13. Krone, Michael ; Frieß, Florian ; Scharnowski, Katrin ; Reina, Guido ; Fademrecht, Silvia ; Kulschewski, Tobias ; Pleiss, Jürgen ; Ertl, Thomas: Molecular Surface Maps. In: IEEE Transactions on Visualization and Computer Graphics (Proceedings of the Scientific Visualization 2016), IEEE Transactions on Visualization and Computer Graphics (Proceedings of the Scientific Visualization 2016). Bd. 23 (2017a), Nr. 1
  14. Krone, Michael ; Reina, Guido ; Zahn, Sebastian ; Tremel, Tina ; Bahnmüller, Carsten ; Ertl, Thomas: Implicit Sphere Shadow Maps. In: IEEE PacificVis - Visualization Notes, IEEE PacificVis - Visualization Notes. Bd. 4, 2017b
  15. Krone, Michael ; Schatz, Karsten ; Hieronymus, Nora ; Müller, Christoph ; Becher, Michael ; Barthelmes, Tina ; Cooper, April ; Currle, Steffen ; u. a.: From Visualization Research to Public Presentation - Design and Realization of a Scientific Exhibition. In: Proceedings of SIGRAD 2017, Proceedings of SIGRAD 2017, 2017c
  16. Markthaler, Daniel ; Zeman, Johannes ; Baz, Jörg ; Smiatek, Jens ; Hansen, Niels: Validation of Trimethylamine-N-oxide (TMAO) Force Fields Based on Thermophysical Properties of Aqueous TMAO Solutions. In: Journal of Physical Chemistry B, Journal of Physical Chemistry B. Bd. 121 (2017), Nr. 47, S. 10674--10688
  17. Pleiss, J.: Thermodynamic activity-based interpretation of enzyme kinetics. In: Trends in Biotechnology, Trends in Biotechnology. Bd. 35 (2017a), S. 379–382
  18. Pleiss, Jürgen: Thermodynamic Activity-Based Progress Curve Analysis in Enzyme Kinetics. In: Trends in Biotechnology, Trends in Biotechnology. Bd. 36 (2017b), Nr. 3, S. 234–238
  19. Rau, Tobias ; Krone, Michael ; Reina, Guido ; Ertl, Thomas: Challenges and Opportunities using Software-defined Visualization in MegaMol. In: 7th Workshop on Visual Analytics, Information Visualization and Scientific Visualization, 7th Workshop on Visual Analytics, Information Visualization and Scientific Visualization, 2017
  20. Reinhardt, Stefan ; Huber, Markus ; Dumitrescu, Otilia ; Krone, Michael ; Eberhardt, Bernhard ; Weiskopf, Daniel: Visual Debugging of SPH Simulations. In: International Conference on Information Visualisation (IV), International Conference on Information Visualisation (IV). Bd. 21, 2017, S. 117–126
  21. Sajadi, S. ; Hocker, Stephen ; Mora, A. ; Binkele, Peter ; Seeger, J. ; Schmauder, Siegfried: Precipitation in a copper matrix modeled by ab initio calculations and atomistic kinetic Monte Carlo simulations. In: Physica Status Solidi B, Physica Status Solidi B. Bd. 254 (2017), Nr. 4
  22. Schatz, Karsten ; Krone, Michael ; Müller, Christoph ; Schneider, Jens ; Reina, Guido ; Ertl, Thomas: Visualization of Halo Topologies in Dark Matter Simulations. In: Proceedings of TopoInVis, Proceedings of TopoInVis, 2017. — Rezensiertes Abstract
  23. Sivaraman, Ganesh ; Amorim, Rodrigo G. ; Scheicherb, Ralph H. ; Fyta, Maria: Insights into the detection of mutations and epigenetic markers using diamondoidfunctionalized sensors. In: RSC Advances, RSC Advances. Bd. 7 (2017), Nr. 68, S. 43064–43072
  24. Smiatek, Jens ; Hansen, Niels ; Kastner, Johannes: Free Energy Calculation Methods and Rare Event Sampling Techniques for Biomolecular Simulations. In: Simulating Enzyme Reactivity: Computational Methods in Enzyme Catalysis, Simulating Enzyme Reactivity: Computational Methods in Enzyme Catalysis : The Royal Society of Chemistry, 2017 — ISBN 978-1-78262-429-5, S. 185--214
  25. Zhou, Liang ; Weiskopf, Daniel: Indexed-Points Parallel Coordinates Visualization of Multivariate Correlations. In: IEEE Transactions on Visualization and Computer Graphics, IEEE Transactions on Visualization and Computer Graphics. (2017)