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Startseite Rabben, Robert Julian

Rabben, Robert Julian

Kontakt

Room
4035
Email
E-Mail
Bereich
Mathematics of Complex Systems
Abteilung
Modeling and Simulation of Complex Processes
Arbeitsgruppe
Computational Molecular Design

Projects

Projects as Member

HPC and Machine Learning for Drug Discovery

HPC and ML for Drug Discovery

High-performance computers are required to simulate complex systems that allow to study the behavior of molecules under real conditions. This project combines artificial...

HPC and ML for Drug Discovery

Publications

2024
Capturing the Macroscopic Behaviour of Molecular Dynamics with Membership Functions 2024 (accepted for publication) Alexander Sikorski, Robert Julian Rabben, Surahit Chewle, Marcus Weber BibTeX
arXiv
2020
ISOKANN: Invariant subspaces of Koopman operators learned by a neural network The Journal of Chemical Physics, 153(11), p. 114109, 2020 Robert Julian Rabben, Sourav Ray, Marcus Weber BibTeX
DOI