Binding interaction analysis of the active site and its inhibitors for neuraminidase (N1 subtype) of human influenza virus by the integration of molecular docking, FMO calculation and 3D-QSAR CoMFA modeling.
Zhang Q, Yang J, Liang K, Feng L, Li S, Wan J, Xu X, Yang G, Liu D, Yang S, J Chem Inf Model, 2008 Sep - link

Prediction of binding for a kind of non-peptic HCV NS3 serine protease inhibitors from plants by molecular docking and MM-PBSA method.
Li X, Zhang W, Qiao X, Xu X, Bioorg Med Chem, 2007 Jan 1 - link

Mapping the binding site of a large set of quinazoline type EGF-R inhibitors using molecular field analyses and molecular docking studies.
Hou T, Zhu L, Chen L, Xu X, J Chem Inf Comput Sci, 2003 Jan-Feb - link

Molecular docking studies of a group of hydroxamate inhibitors with gelatinase-A by molecular dynamics.
Hou T, Zhang W, Xu X, J Comput Aided Mol Des, 2002 Jan - link

Automated docking of peptides and proteins by using a genetic algorithm combined with a tabu search.
Hou T, Wang J, Chen L, Xu X, Protein Eng, 1999 Aug - link