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cs.LG2026
Generating Physically Consistent Molecules with Energy-Based Models
Christoph Griesbacher, Lea Bogensperger, Andreas Habring +1
Molecules in equilibrium follow a Boltzmann distribution, making the underlying energy landscape a physically grounded modeling objective. However, such landscapes are difficult to…
math.ST2026
Time-Inhomogeneous Preconditioned Langevin Dynamics
Alexander Falk, Laurenz Nagler, Andreas Habring +1
Langevin sampling from distributions of the form faces two major challenges: (global) mode coverage and (local) mode exploration. The first challenge is…