FFF: Fragment-Guided Flexible Fitting for Building Complete Protein Structures. - Weijie Chen; Xinyan Wang 007; Yuhang Wang (CVPR, 2023)

FFF: Fragments-Guided Flexible Fitting for Building Complete Protein Structures. - Weijie Chen; Xinyan Wang 007; Yuhang Wang (CoRR, 2023)

On the design space between molecular mechanics and machine learning force fields. - Yuanqing Wang; Kenichiro Takaba; Michael S. Chen; Marcus Wieder; Yuzhi Xu; Tong Zhu; John Z. H. Zhang; Arnav Nagle; Kuang Yu; Xinyan Wang 007; Daniel J. Cole; Joshua A. Rackers; et al. (CoRR, 2024)

Data-Driven Parametrization of All-Atom Force Fields for Organic Semiconductors. - Guojiang Zhao; Taiping Hu; Yingfeng Zhang; Hongshuai Wang; Lirong Wu; Shuqi Lu; Fengtianci Yang; Shangqian Chen; Zhifeng Gao; Xinyan Wang 007; Zheng Cheng (J. Chem. Inf. Model., 2025)