Conformational Dynamics and Thermal Stabilities of the αβ-Tubulin Dimer: A Molecular Dynamics Simulation Study. - Xiaomin Wu; Gang Yang 003; Yuangang Zu; Zhiwei Yang 003; Lijun Zhou (Silico Biol., 2009)

Mutation effects of neuraminidases and their docking with ligands: a molecular dynamics and free energy calculation study. - Zhiwei Yang 003; Gang Yang 003; Lijun Zhou (J. Comput. Aided Mol. Des., 2013)

Molecular Insights into the Recruiting Between UCP2 and DDX5/UBAP2L in the Metabolic Plasticity of Non-Small-Cell Lung Cancer. - Zhiwei Yang 003; Guoyin Li 003; Yizhen Zhao; Lei Zhang 180; Xiaohui Yuan; Lingjie Meng; Huadong Liu; Yong Han; Lintao Jia; Shengli Zhang (J. Chem. Inf. Model., 2021)

Mechanism of Glycans Modulating Cholesteryl Ester Transfer Protein: Unveiled by Molecular Dynamics Simulation. - Dongxiao Hao; He Wang 015; Yongjian Zang; Lei Zhang 180; Zhiwei Yang 003; Shengli Zhang (J. Chem. Inf. Model., 2022)

p38α Kinase Auto-Activation through Its Conformational Transition Induced by Tyr323 Phosphorylation. - Yongjian Zang; He Wang 015; Dongxiao Hao; Ying Kang; Jianwen Zhang; Xuhua Li; Lei Zhang 180; Zhiwei Yang 003; Shengli Zhang (J. Chem. Inf. Model., 2022)

MESPool: Molecular Edge Shrinkage Pooling for hierarchical molecular representation learning and property prediction. - Fanding Xu; Zhiwei Yang 003; Lizhuo Wang; Deyu Meng; Jiangang Long (Briefings Bioinform., 2023)