Preprint
Nov 2026
SO3LR Tauri: Generally Applicable Force Fields for Reactive (Bio)Molecular Simulations Covering the Periodic Table
Machine-learned force fields (MLFFs) aim to create a unified model that describes all major classes of (bio)molecules at quantum-mechanical accuracy. We present SO3LR Tauri, a family of MLFFs developed toward this goal, coupling a fast SO3krates network to explicit, physics-based interaction modules: pair-specific shor...
A. Kabylda, F. Brunig, Miguel Gallegos et al.
· 0 citations