article Open AccessTop 10% cited
Binding interaction of quercetin-3-β-galactoside and its synthetic derivatives with SARS-CoV 3CLpro: Structure–activity relationship studies reveal salient pharmacophore features
Bioorganic & Medicinal Chemistry · 2006 · Vol. 14(24) · pp. 8295–8306
Lili Chen✉(Chinese Academy of Sciences)Jian Li(Shanghai Institute of Materia Medica)Cheng Luo(Chinese Academy of Sciences)Hong Liu(Chinese Academy of Sciences)Weijun Xu(Singapore Polytechnic)Gang Chen(Singapore Polytechnic)Oi Wah Liew(Singapore Polytechnic)Weiliang Zhu(Chinese Academy of Sciences)Chum Mok Puah(Singapore Polytechnic)Xu Shen(Shanghai Institute of Materia Medica)Hualiang Jiang(Shanghai Institute of Materia Medica)
Computational Drug Discovery MethodsSynthesis and biological activityBioactive Compounds and Antitumor AgentsChemistryPharmacophoreStereochemistryStructure–activity relationshipMoietyDrug discoveryNatural productQuercetinMolecular modelBiochemistry
MeSH terms
Coronavirus 3C ProteasesBinding SitesCysteine EndopeptidasesHumansModels, MolecularProtease InhibitorsQuercetinStructure-Activity RelationshipViral ProteinsDrug DesignMolecular StructureSevere acute respiratory syndrome-related coronavirus
Funding
- National Key Research and Development Program of China
Citations
268
FWCI
4.74
field-weighted impact
References
43
Percentile
95%
vs. same field & year
Citations per year
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References
Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges
Tetrahedron · 1980 · 4,075 citations
A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules
Journal of the American Chemical Society · 1995 · 13,076 citations
Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function
Journal of Computational Chemistry · 1998 · 10,757 citations
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