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List of works by Dong-Qing Wei

A Pharmacophore Model Specific to Active Site of CYP1A2 with a Novel Molecular Modeling Explorer and CoMFA ⬇️

scientific article published on March 1, 2012

Agaritine and its derivatives are potential inhibitors against HIV proteases

scientific article

An allosteric mechanism inferred from molecular dynamics simulations on phospholamban pentamer in lipid membranes

scientific article

Binding mechanism of H5N1 influenza virus neuraminidase with ligands and its implication for drug design

scientific article published in May 2009

Binding mechanism of coronavirus main proteinase with ligands and its implication to drug design against SARS.

scientific article published in August 2003

Binding of CYP2C9 with diverse drugs and its implications for metabolic mechanism.

scientific article published in May 2009

Drug candidates from traditional chinese medicines

scientific article

Insights from investigating the interactions of adamantane-based drugs with the M2 proton channel from the H1N1 swine virus

scientific article published on 8 August 2009

Insights from modeling the 3D structure of H5N1 influenza virus neuraminidase and its binding interactions with ligands

scientific article published on 19 April 2006

Insights from modeling the 3D structure of NAD(P)H-dependent D-xylose reductase of Pichia stipitis and its binding interactions with NAD and NADP.

scientific article published on 24 May 2007

Molecular dynamics studies on the interactions of PTP1B with inhibitors: from the first phosphate-binding site to the second one.

scientific article published on 19 April 2009

Molecular insights of SAH enzyme catalysis and implication for inhibitor design

scientific article published on 16 September 2006

Molecular modeling of two CYP2C19 SNPs and its implications for personalized drug design

scientific article published in January 2008

Polyprotein cleavage mechanism of SARS CoV Mpro and chemical modification of the octapeptide

scientific article published in November 2004

Possible drug candidates for Alzheimer's disease deduced from studying their binding interactions with alpha7 nicotinic acetylcholine receptor.

scientific article published in May 2009

Predicting protein-ligand binding sites based on an improved geometric algorithm

scientific article published in October 2011

Progress in computational approach to drug development against SARS.

scientific article published on January 2006

SCYPPred: a web-based predictor of SNPs for human cytochrome P450.

scientific article published in January 2012

Screening for new agonists against Alzheimer's disease

scientific article published in September 2007

Structure of cytochrome p450s and personalized drug

scientific article published on January 2009

The Nemertine Toxin Anabaseine and Its Derivative DMXBA (GTS-21): Chemical and Pharmacological Properties

scientific article

The computational model to predict accurately inhibitory activity for inhibitors towards CYP3A4.

scientific article published on 16 October 2010

Theoretical studies of Alzheimer's disease drug candidate 3-[(2,4-dimethoxy)benzylidene]-anabaseine (GTS-21) and its derivatives

scientific article published on 21 October 2005

Virtual screening for SARS-CoV protease based on KZ7088 pharmacophore points

scientific article

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