Simon Olsson

Boltzmann generators: Sampling equilibrium states of many-body systems with deep learning

Frank Noé, Simon Olsson, Jonas Köhler et al. · Science · 2019 · 706 citations

Engineering, Machine Learning, Equilibrium States +16

Machine Learning of Coarse-Grained Molecular Dynamics Force Fields

Jiang Wang, Simon Olsson, Christoph Wehmeyer et al. · ACS Central Science · 2019 · 491 citations · Full text

Geometric Learning, Engineering, Machine Learning +12

Camostat mesylate inhibits SARS-CoV-2 activation by TMPRSS2-related proteases and its metabolite GBPA exerts antiviral activity

Markus Hoffmann, Heike Hofmann-Winkler, Joan C. Smith et al. · EBioMedicine · 2021 · 385 citations · Full text

Coarse graining molecular dynamics with graph neural networks

Brooke E. Husic, Nicholas E. Charron, Dominik Lemm et al. · Refubium (Universitätsbibliothek der Freien Universität Berlin) · 2020 · 166 citations · Full text

Combining experimental and simulation data of molecular processes via augmented Markov models

Simon Olsson, Hao Wu, Fabian Paul et al. · Proceedings of the National Academy of Sciences · 2017 · 115 citations · Full text

Engineering, Molecular Biology, Simulation +20