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Multi-fidelity graph neural networks for predicting toluene/water partition coefficients2025 Journal of Cheminformatics article Pharmacology, Toxicology and Pharmaceutics Computational Drug Discovery Methods Open access
Thomas Nevolianis, Jan G. Rittig, Alexander Mitsos, Kai O. Leonhard
10citations -
Accurately Solving Rod Dynamics with Graph Learning2021 King Abdullah University of Science and Technology Repository (King Abdullah University of Science and Technology) conference-paper Computer Science Computer Graphics and Visualization Techniques
Tassilo Kugelstadt, Torsten Hädrich, Wojtek Pałubicki, Jan Bender, Sören Pirk, Dominik Ludewig Michels
6citations -
Enhancements to the IceCube Extremely High Energy Neutrino Selection using Graph & Transformer Based Neural Networks2025 International Cosmic Ray Conference conference-paper Physics and Astronomy Astrophysics and Cosmic Phenomena Open access
Maxwell Nakos, Aske Rosted, Lu Lu, M. Ackermann, Jenni Adams, Sanjib Kumar Agarwalla, +91 more
1citations -
Graph theory for the analysis of micro-electrode array recordings of human brain slices – framework and benchmarking2026 bioRxiv (Cold Spring Harbor Laboratory) preprint Neuroscience Functional Brain Connectivity Studies Open access
Jonas Ort, Victoria Sofie Witzig, Aniella Bak, Jan Heckelmann, Ann-Kathrin Roeb, Hussam Hamou, +5 more
0citations -
Graph Theory Benchmarking MEA Data Set - Human Brain Slice Cultures, 252 recording channels2026 Zenodo (CERN European Organization for Nuclear Research) dataset Neuroscience Neural dynamics and brain function Open access
Jonas Ort, Victoria Sofie Witzig, Aniella Bak, Jan Heckelmann, Ann-Kathrin Roeb, Henner Koch, +1 more
0citations