Molecular Dynamics Study to Investigate the Dimeric Structure of the Full-Length α-Synuclein in Aqueous Solution. - Tingting Zhang; Yuan-xin Tian; Zhonghuang Li; Siming Liu; Xiang Hu; Zichao Yang; Xiaotong Ling; Shuwen Liu; Jiajie Zhang (J. Chem. Inf. Model., 2017)

Understand the acquired resistance of RTK inhibitors by computational receptor tyrosine kinases network. - Yuan-xin Tian; Yunci Ma; Shaoyu Wu; Tingting Zhang; Zhonghuang Li; Guangfa Wang; Jiajie Zhang (Comput. Biol. Chem., 2018)

Discovery and Computational Studies of Potent Covalent Kinase Inhibitors with α-Substituent Electrophiles Targeting Cysteine. - Yangcheng Ai; Zichao Yang; Zilong Yang; Shanhe Wan; Chunhui Huang; Chuan Huang; Mingxia Li; Zhonghuang Li; Jiajie Zhang; Tingting Zhang (J. Chem. Inf. Model., 2023)