Physics-Grounded Evaluation to Guide Accurate Biomolecular Prediction
Ningyi Lyu, Siyuan Du, Qianzhen Shao, Zhongyue John Yang, Jianpeng Ma, Daniel Herschlag
This paper evaluates current biomolecular structure prediction models using physics-based criteria, revealing widespread errors in capturing atomic interactions and conformational preferences.
bioRxiv · Jun 30, 2025 · PreprintBiophysics