Henrik Schopmans

11 papers A* 2Journal 9
YearRankTypeTitle / Venue / Authors
2026 J jnl
Efficient Training of Boltzmann Generators Using Off-Policy Log-Dispersion Regularization.
CoRR
Henrik Schopmans, Christopher von Klitzing, Pascal Friederich
2025 J jnl
Generative models for crystalline materials.
CoRR
Houssam Metni, Laura Ruple, Lauren N. Walters, Luca Torresi, Jonas Teufel, Henrik Schopmans, Jona Östreicher, Yumeng Zhang, Marlen Neubert, Yuri Koide, Kevin Steiner, Paul Link, Lukas Bär, Mariana Petrova, Gerbrand Ceder, Pascal Friederich
2025 J jnl
Learning Boltzmann Generators via Constrained Mass Transport.
CoRR
Christopher von Klitzing, Denis Blessing, Henrik Schopmans, Pascal Friederich, Gerhard Neumann
2025 J jnl
Symmetry-Aware Bayesian Flow Networks for Crystal Generation.
CoRR
Laura Ruple, Luca Torresi, Henrik Schopmans, Pascal Friederich
2025 A* conf
Temperature-Annealed Boltzmann Generators.
ICML
Henrik Schopmans, Pascal Friederich
2025 J jnl
Temperature-Annealed Boltzmann Generators.
CoRR
Henrik Schopmans, Pascal Friederich
2025 J jnl
opXRD: Open Experimental Powder X-ray Diffraction Database.
CoRR
Daniel Hollarek, Henrik Schopmans, Jona Östreicher, Jonas Teufel, Bin Cao, Adie Alwen, Simon Schweidler, Mriganka Singh, Tim Kodalle, Hanlin Hu, Gregoire Heymans, Maged Abdelsamie, Arthur Hardiagon, Alexander Wieczorek, Siarhei Zhuk, Ruth Schwaiger, Sebastian Siol, François-Xavier Coudert, Moritz Wolf, Carolin M. Sutter-Fella, Ben Breitung, Andrea M. Hodge, Tong-yi Zhang, Pascal Friederich
2024 A* conf
Conditional Normalizing Flows for Active Learning of Coarse-Grained Molecular Representations.
ICML
Henrik Schopmans, Pascal Friederich
2024 J jnl
Conditional Normalizing Flows for Active Learning of Coarse-Grained Molecular Representations.
CoRR
Henrik Schopmans, Pascal Friederich
2023 J jnl
Neural networks trained on synthetically generated crystals can extract structural information from ICSD powder X-ray diffractograms.
CoRR
Henrik Schopmans, Patrick Reiser, Pascal Friederich
2022 J jnl
Graph neural networks for materials science and chemistry.
CoRR
Patrick Reiser, Marlen Neubert, André Eberhard, Luca Torresi, Chen Zhou, Chen Shao, Houssam Metni, Clint van Hoesel, Henrik Schopmans, Timo Sommer, Pascal Friederich