Dabo Pan

Search for β2 Adrenergic Receptor Ligands by Virtual Screening via Grid Computing and Investigation of Binding Modes by Docking and Molecular Dynamics Simulations

Yang Zhang, Qifeng Bai, Xiaojun Yao, 2014, PloS one.

Computational study on the drug resistance mechanism of hepatitis C virus NS5B RNA-dependent RNA polymerase mutants to BMS-791325 by molecular dynamics simulation and binding free energy calculations

Huanxiang Liu, Qifeng Bai, Xiaojun Yao, 2016 .

Molecular modeling study on the resistance mechanism of HCV NS3/4A serine protease mutants R155K, A156V and D168A to TMC435.

Huanxiang Liu, Xiaojun Yao, Dabo Pan, 2012, Antiviral research.

Exploring the molecular basis of dsRNA recognition by NS1 protein of influenza A virus using molecular dynamics simulation and free energy calculation.

Huanxiang Liu, Xiaojun Yao, Dabo Pan, 2011, Antiviral research.

Prediction of zanamivir efficiency over the possible 2009 Influenza A (H1N1) mutants by multiple molecular dynamics simulations and free energy calculations

Huanxiang Liu, Xiaojun Yao, Dabo Pan, 2011, Journal of molecular modeling.