Jie Shen

Exploring coumarin egress channels in human cytochrome p450 2a6 by random acceleration and steered molecular dynamics simulations

Weihua Li, Yun Tang, Tyuji Hoshino, 2011, Proteins.

Discovery and structure-activity analysis of selective estrogen receptor modulators via similarity-based virtual screening.

Jin Huang, Yun Tang, Guixia Liu, 2012, European journal of medicinal chemistry.

In SilicoPrediction of Blood–Brain Partitioning Using a Chemometric Method Called Genetic Algorithm Based Variable Selection

Yun Tang, Yiping Du, Guixia Liu, 2008 .

Investigation of Indazole Unbinding Pathways in CYP2E1 by Molecular Dynamics Simulations

Feixiong Cheng, Weihua Li, Yun Tang, 2012, PloS one.

Possible ligand release pathway of dipeptidyl peptidase IV investigated by molecular dynamics simulations

Weihua Li, Yun Tang, Cui Li, 2011, Proteins.

Discovery of potent ligands for estrogen receptor beta by structure-based virtual screening.

Weihua Li, Jin Huang, Yun Tang, 2010, Journal of medicinal chemistry.