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Journal Articles
- 2023
[j9]Kuan Liang, Wanqian Dong, Jiamin Gao, Zhenhao Liu, Rui Zhou, Zhengyu Shu, Mojie Duan:
The Conformational Transitions and Dynamics of Burkholderia cepacia Lipase Regulated by Water-Oil Interfaces. J. Chem. Inf. Model. 63(12): 3854-3864 (2023)- [j8]Zhenhao Liu
, Kuan Liang, Wenlang Liu, Tao Jiang, Rui Zhou, Mojie Duan, Zheng Zheng:
Molecular Insights on the Conformational Transitions and Activity Regulation of the c-Met Kinase Induced by Ligand Binding. J. Chem. Inf. Model. 63(13): 4147-4157 (2023) - [j7]Haiyi Chen, Yue Guo, Shengqing Ye, Jintu Zhang, Haotian Zhang, Na Liu, Rui Zhou, Tingjun Hou, Hongguang Xia, Yu Kang, Mojie Duan:
On the Dynamic Mechanism of Long-Flexible Fatty Acid Binding to Fatty Acid Binding Protein: Resolving the Long-Standing Debate. J. Chem. Inf. Model. 63(16): 5232-5243 (2023) - 2022
- [j6]Tao Jiang, Zhenhao Liu, Wenlang Liu, Jiawen Chen, Zheng Zheng, Mojie Duan:
The Conformational Transition Pathways and Hidden Intermediates in DFG-Flip Process of c-Met Kinase Revealed by Metadynamics Simulations. J. Chem. Inf. Model. 62(15): 3651-3663 (2022) - [j5]Haiyi Chen, Rui Zhou, Jinping Pang, Yue Guo, Jiawen Chen, Yu Kang, Mojie Duan, Tingjun Hou:
Molecular View on the Dissociation Pathways and Transactivation Regulation Mechanism of Nonsteroidal GR Ligands. J. Chem. Inf. Model. 62(21): 5233-5245 (2022) - [j4]Wanqian Dong, Rui Zhou, Jiawen Chen, Zhengyu Shu, Mojie Duan:
Phosphorylation Regulation on the Homo-Dimeric Binding of Transactive Response DNA-Binding Protein. J. Chem. Inf. Model. 62(21): 5267-5275 (2022) - 2019
- [j3]Ye Jin, Mojie Duan, Xuwen Wang, Xiaotian Kong, Wenfang Zhou, Huiyong Sun, Hui Liu, Dan Li, Huidong Yu, Youyong Li, Tingjun Hou:
Communication between the Ligand-Binding Pocket and the Activation Function-2 Domain of Androgen Receptor Revealed by Molecular Dynamics Simulations. J. Chem. Inf. Model. 59(2): 842-857 (2019) - 2018
- [j2]Wenfang Zhou, Mojie Duan, Weitao Fu, Jinping Pang, Qin Tang, Huiyong Sun, Lei Xu, Shan Chang, Dan Li, Tingjun Hou:
Discovery of Novel Androgen Receptor Ligands by Structure-based Virtual Screening and Bioassays. Genom. Proteom. Bioinform. 16(6): 416-427 (2018) - [j1]Na Liu, Wenfang Zhou, Yue Guo, Junmei Wang, Weitao Fu, Huiyong Sun, Dan Li, Mojie Duan, Tingjun Hou:
Molecular Dynamics Simulations Revealed the Regulation of Ligands to the Interactions between Androgen Receptor and Its Coactivator. J. Chem. Inf. Model. 58(8): 1652-1661 (2018)
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