Rational Prediction of the Herbicidal Activities of Novel Protoporphyrinogen Oxidase Inhibitors by Quantitative Structure-Activity Relationship Model Based on Docking-Guided Active Conformation.
Lei B, Li J, Lu J, Du J, Liu H, Yao X, J Agric Food Chem, 2009 Sep 25 - link

Novel fatty acid synthase (FAS) inhibitors: design, synthesis, biological evaluation, and molecular docking studies.
Wang X, Lin J, Chen Y, Zhong W, Zhao G, Liu H, Li S, Wang L, Li S, Bioorg Med Chem, 2009 Mar 1 - link

[Molecular docking of epidermal growth factor receptor tyramine kinase domain and its inhibitor genistein]
Yuan J, Liu H, Kang X, Zou G, Sheng Wu Gong Cheng Xue Bao, 2008 Oct - link

Molecular modeling studies of vascular endothelial growth factor receptor tyrosine kinase inhibitors using QSAR and docking.
Du J, Lei B, Qin J, Liu H, Yao X, J Mol Graph Model, 2009 Jan - link

3D-QSAR and molecular docking studies of selective agonists for the thyroid hormone receptor beta.
Du J, Qin J, Liu H, Yao X, J Mol Graph Model, 2008 Sep - link

Binding of puerarin to human serum albumin: a spectroscopic analysis and molecular docking.
He Y, Wang Y, Tang L, Liu H, Chen W, Zheng Z, Zou G, J Fluoresc, 2008 Mar - link

Probing ligand binding modes of human cytochrome P450 2J2 by homology modeling, molecular dynamics simulation, and flexible molecular docking.
Li W, Tang Y, Liu H, Cheng J, Zhu W, Jiang H, Proteins, 2008 May 1 - link

Essential structural profile of a dual functional inhibitor against cyclooxygenase-2 (COX-2) and 5-lipoxygenase (5-LOX): molecular docking and 3D-QSAR analyses on DHDMBF analogues.
Zheng M, Zhang Z, Zhu W, Liu H, Luo X, Chen K, Jiang H, Bioorg Med Chem, 2006 May 15 - link

Structural basis for SUMO-E2 interaction revealed by a complex model using docking approach in combination with NMR data.
Ding H, Yang Y, Zhang J, Wu J, Liu H, Shi Y, Proteins, 2005 Dec 1 - link

Molecular docking and 3D QSAR studies on 1-amino-2-phenyl-4-(piperidin-1-yl)-butanes based on the structural modeling of human CCR5 receptor.
Xu Y, Liu H, Niu C, Luo C, Luo X, Shen J, Chen K, Jiang H, Bioorg Med Chem, 2004 Dec 1 - link

Inhibitory mode of indole-2-carboxamide derivatives against HLGPa: molecular docking and 3D-QSAR analyses.
Liu G, Zhang Z, Luo X, Shen J, Liu H, Shen X, Chen K, Jiang H, Bioorg Med Chem, 2004 Aug 1 - link

Simulation of the interaction between ScyTx and small conductance calcium-activated potassium channel by docking and MM-PBSA.
Wu Y, Cao Z, Yi H, Jiang D, Mao X, Liu H, Li W, Biophys J, 2004 Jul - link

Elucidating inhibitory models of the inhibitors of epidermal growth factor receptor by docking and 3D-QSAR.
Chen G, Luo X, Zhu W, Luo C, Liu H, Puah CM, Chen K, Jiang H, Bioorg Med Chem, 2004 May 1 - link

Inhibitory mode of 1,5-diarylpyrazole derivatives against cyclooxygenase-2 and cyclooxygenase-1: molecular docking and 3D QSAR analyses.
Liu H, Huang X, Shen J, Luo X, Li M, Xiong B, Chen G, Shen J, Yang Y, Jiang H, Chen K, J Med Chem, 2002 Oct 24 - link