Song Fan

Investigation on the mechanism for the binding and drug resistance of wild type and mutations of G86 residue in HIV-1 protease complexed with Darunavir by molecular dynamic simulation and free energy calculation

Ju-Guang Han, Dan Li, Ying Zhang, 2014, Journal of Molecular Modeling.

The binding mechanism of a novel nicotinamide isostere inhibiting with TNKSs: a molecular dynamic simulation and binding free energy calculation

Ju-Guang Han, Yan-Jun Zhang, Song Fan, 2016, Journal of biomolecular structure & dynamics.

Insights into resistance mechanism of the macrolide biosensor protein MphR(A) binding to macrolide antibiotic erythromycin by molecular dynamics simulation

Yanjun Zhang, Song Fan, Tingting Feng, 2015, Journal of Computer-Aided Molecular Design.

Molecular dynamics study of segment peptides of Bax, Bim, and Mcl-1 BH3 domain of the apoptosis-regulating proteins bound to the anti-apoptotic Mcl-1 protein

Ju-Guang Han, Run-Ning Zhao, Song Fan, 2015, Journal of biomolecular structure & dynamics.