Klein, Leon

9 publications

NeurIPS 2025 Amortized Sampling with Transferable Normalizing Flows Charlie B. Tan, Majdi Hassan, Leon Klein, Saifuddin Syed, Dominique Beaini, Michael M. Bronstein, Alexander Tong, Kirill Neklyudov

NeurIPS 2025 Consistent Sampling and Simulation: Molecular Dynamics with Energy-Based Diffusion Models Michael Plainer, Hao Wu, Leon Klein, Stephan Günnemann, Frank Noe

ICLRW 2025 FreeFlow: Latent Flow Matching for Free Energy Difference Estimation Ege Erdogan, Radoslav Ralev, Mika Rebensburg, Céline Marquet, Leon Klein, Hannes Stark

NeurIPS 2025 Path Gradients After Flow Matching Lorenz Vaitl, Leon Klein

ICML 2025 Scalable Equilibrium Sampling with Sequential Boltzmann Generators Charlie B. Tan, Joey Bose, Chen Lin, Leon Klein, Michael M. Bronstein, Alexander Tong

ICLRW 2025 Scalable Equilibrium Sampling with Sequential Boltzmann Generators Charlie B. Tan, Joey Bose, Chen Lin, Leon Klein, Michael M. Bronstein, Alexander Tong

NeurIPS 2024 Transferable Boltzmann Generators Leon Klein, Frank Noé

NeurIPS 2023 Equivariant Flow Matching Leon Klein, Andreas Krämer, Frank Noe

NeurIPS 2023 Timewarp: Transferable Acceleration of Molecular Dynamics by Learning Time-Coarsened Dynamics Leon Klein, Andrew Foong, Tor Fjelde, Bruno Mlodozeniec, Marc Brockschmidt, Sebastian Nowozin, Frank Noe, Ryota Tomioka