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2020 – today
- 2020
[j5]Rongfeng Zou
, Yang Zhou, Yong Wang, Guanglin Kuang, Hans Ågren, Junchen Wu, Yaoquan Tu:
Free Energy Profile and Kinetics of Coupled Folding and Binding of the Intrinsically Disordered Protein p53 with MDM2. J. Chem. Inf. Model. 60(3): 1551-1558 (2020)- [j4]Junhao Li, Yang Zhou, Yun Tang, Weihua Li, Yaoquan Tu:
Dissecting the Structural Plasticity and Dynamics of Cytochrome P450 2B4 by Molecular Dynamics Simulations. J. Chem. Inf. Model. 60(10): 5026-5035 (2020)
2010 – 2019
- 2019
- [j3]Yang Zhou, Rongfeng Zou, Guanglin Kuang, Bengt Långström, Christer Halldin, Hans Ågren, Yaoquan Tu:
Enhanced Sampling Simulations of Ligand Unbinding Kinetics Controlled by Protein Conformational Changes. J. Chem. Inf. Model. 59(9): 3910-3918 (2019) - 2011
- [j2]Li Gao, Yaoquan Tu, Pia Wegman, Sten Wingren, Leif A. Eriksson:
Conformational Enantiomerization and Estrogen Receptor α Binding of Anti-Cancer Drug Tamoxifen and Its Derivatives. J. Chem. Inf. Model. 51(2): 306-314 (2011) - [j1]Li Gao, Yaoquan Tu, Pia Wegman, Sten Wingren, Leif A. Eriksson:
A Mechanistic Hypothesis for the Cytochrome P450-Catalyzed Cis-Trans Isomerization of 4-Hydroxytamoxifen: An Unusual Redox Reaction. J. Chem. Inf. Model. 51(9): 2293-2301 (2011)
2000 – 2009
- 2006
- [c1]Yaoquan Tu, Lennart Nilsson, Aatto Laaksonen:
A Highly Efficient Ab Initio Tight-Binding-Like Approximate Density-Functional Quantum Mechanical Method. PARA 2006: 100-108
Coauthor Index
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