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Biophysical Journal|March 1, 2003
Thermodynamic characterization of the folding coupled DNA binding by the monomeric transcription activator GCN4 peptideXu Wang, Wei Cao, Aoneng Cao, et al.Proteins|September 25, 2004
Estimating protein-ligand binding free energy: atomic solvation parameters for partition coefficient and solvation free energy calculationJianfeng Pei, Qi Wang, Jiaju Zhou, et al.Plos One|April 16, 2014
Discovery of novel allosteric effectors based on the predicted allosteric sites for Escherichia coli D-3-phosphoglycerate dehydrogenaseQian Wang, Yifei Qi, Ning Yin, et al.Journal of Chemical Information and Modeling|June 28, 2024
Challenging Complexity with Simplicity: Rethinking the Role of Single-Step Models in Computer-Aided Synthesis PlanningJunren Li, Kangjie Lin, Jianfeng Pei, et al.Computational and Structural Biotechnology Journal|November 27, 2019
Discovery of novel helix binding sites at protein-protein interfacesWei Yang, Xiangyu Sun, Changsheng Zhang, et al.Molecular Biosystems|April 25, 2013
Understanding traditional Chinese medicine anti-inflammatory herbal formulae by simulating their regulatory functions in the human arachidonic acid metabolic networkShuo Gu, Ning Yin, Jianfeng Pei, et al.European Journal of Medicinal Chemistry|December 11, 2012
Optimization of 5-hydroxytryptamines as dual function inhibitors targeting phospholipase A2 and leukotriene A4 hydrolaseHu Meng, Ying Liu, Yujing Zhai, et al.Current Opinion in Structural Biology|March 11, 2020
Allostery of multidomain proteins with disordered linkersQiaojing Huang, Maodong Li, Luhua Lai, et al.Chemical Science|June 14, 2021
Automatic retrosynthetic route planning using template-free modelsKangjie Lin, Youjun Xu, Jianfeng Pei, et al.Scientific Reports|March 3, 2015
Both piston-like and rotational motions are present in bacterial chemoreceptor signalingDaqi Yu, Xiaomin Ma, Yuhai Tu, et al.Pageof 272