Papers matching “structural simulation” 1,456
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Observed structural parameters of EAGLE galaxies: reconciling the mass–size relation in simulations with local observations2021 Monthly Notices of the Royal Astronomical Society article Physics and Astronomy Galaxies: Formation, Evolution, Phenomena Open access
Anna de Graaff, James W. Trayford, Marijn Franx, Matthieu Schaller, Joop Schaye, Arjen van der Wel
57citations -
End-to-end quantum algorithm for topology optimization in structural mechanics2026 Quantum Science and Technology article Computer Science Quantum Computing Algorithms and Architecture Open access
Leonhard Hölscher, Oliver Ahrend, Lukas Karch, Carlotta L'Estocq, Marc Marfany Andreu, Tobias Stollenwerk, +2 more
1citations -
kMap.py: A Python program for simulation and data analysis in photoemission tomography2021 Computer Physics Communications article Materials Science Electron and X-Ray Spectroscopy Techniques Open access
Dominik Brandstetter, Xiaosheng Yang, Daniel Lüftner, Frank Stefan Tautz, Peter Puschnig
1citations -
Structural insights into the effects of glycerol on ligand binding to cytochrome P4502022 Acta Crystallographica Section D Structural Biology article Materials Science Enzyme Structure and Function
Sergey S. Bukhdruker, Tatsiana Varaksa, Philipp S. Orekhov, Irina P. Grabovec, Egor Marin, Ivan Kapranov, +10 more
4citations -
Structural Determinants of Mac1 Inhibition: Lessons from Ligand Binding Patterns2026 Zenodo (CERN European Organization for Nuclear Research) article Computer Science Computational Drug Discovery Methods Open access
Verena Weber, Giulia Rossetti, Bernhard Lüscher, Patricia Korn, Sarah Knapp
0citations -
Structural Determinants of Mac1 Inhibition: Lessons from Ligand Binding Patterns2026 Zenodo (CERN European Organization for Nuclear Research) article Computer Science Computational Drug Discovery Methods Open access
Verena Weber, Giulia Rossetti, Bernhard Lüscher, Patricia Korn, Sarah Knapp
0citations -
Structural characterization of supramolecular hollow nanotubes with atomistic simulations and SAXS2020 Physical Chemistry Chemical Physics article Materials Science Supramolecular Self-Assembly in Materials Open access
Ilias Patmanidis, Alex H. de Vries, Tsjerk A. Wassenaar, Wenjun Wang, Giuseppe Portale, Siewert J. Marrink
22citations -
Role of Tyr-39 for the Structural Features of α-Synuclein and for the Interaction with a Strong Modulator of Its Amyloid Assembly2020 International Journal of Molecular Sciences article Medicine Parkinson's Disease Mechanisms and Treatments Open access
Oscar Palomino‐Hernández, Fiamma A. Buratti, Pamela S. Sacco, Giulia Rossetti, Paolo Carloni, Claudio O. Fernández
12citations