Investigation of allosteric modulation mechanism of metabotropic glutamate receptor 1 by molecular dynamics simulations, free energy and weak interaction analysis

Por Bai, Qifeng, Yao, Xiaojun
Publicado no Sci Rep (2016)

Computational Study on the Different Ligands Induced Conformation Change of β2 Adrenergic Receptor-Gs Protein Complex

Por Bai, Qifeng, Zhang, Yang, Ban, Yihe, Liu, Huanxiang, Yao, Xiaojun
Publicado em 2013

Structural Diversity and Initial Oligomerization of PrP106–126 Studied by Replica-Exchange and Conventional Molecular Dynamics Simulations

Por Ning, Lulu, Guo, Jingjing, Bai, Qifeng, Jin, Nengzhi, Liu, Huanxiang, Yao, Xiaojun
Publicado em 2014

Search for β(2) Adrenergic Receptor Ligands by Virtual Screening via Grid Computing and Investigation of Binding Modes by Docking and Molecular Dynamics Simulations

Por Bai, Qifeng, Shao, Yonghua, Pan, Dabo, Zhang, Yang, Liu, Huanxiang, Yao, Xiaojun
Publicado em 2014

Influence of Chirality of Crizotinib on Its MTH1 Protein Inhibitory Activity: Insight from Molecular Dynamics Simulations and Binding Free Energy Calculations

Por Niu, Yuzhen, Pan, Dabo, Shi, Danfeng, Bai, Qifeng, Liu, Huanxiang, Yao, Xiaojun
Publicado no PLoS One (2015)

Gelsolin-Like Domain 3 Plays Vital Roles in Regulating the Activities of the Lily Villin/Gelsolin/Fragmin Superfamily

Por Qian, Dong, Nan, Qiong, Yang, Yueming, Li, Hui, Zhou, Yuelong, Zhu, Jingen, Bai, Qifeng, Zhang, Pan, An, Lizhe, Xiang, Yun
Publicado no PLoS One (2015)

Modeling a New Water Channel That Allows SET9 to Dimethylate p53

Por Bai, Qifeng, Shen, Yulin, Yao, Xiaojun, Wang, Fang, Du, Yuping, Wang, Qin, Jin, Nengzhi, Hai, Jun, Hu, Tiejun, Yang, Jinbo
Publicado em 2011

The pH stability of foot-and-mouth disease virus

Por Yuan, Hong, Li, Pinghua, Ma, Xueqing, Lu, Zengjun, Sun, Pu, Bai, Xingwen, Zhang, Jing, Bao, Huifang, Cao, Yimei, Li, Dong, Fu, Yuanfang, Chen, Yingli, Bai, Qifeng, Zhang, Jie, Liu, Zaixin
Publicado no Virol J (2017)