A docking study of l-chicoric acid with HIV-1 integrase

Journal of Molecular Graphics and Modelling

Volumn 27, Issue 5, 2009, Pages 584-589

  Healy, Eamonn F ^a   Sanders, Jonathan ^a   King, Peter J ^a   Robinson Jr , W Edward ^b  

^a ST EDWARD'S UNIVERSITY   (United States)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

, Unsaturated ester; Ab initio; AM1; Conformational analysis; HIV 1 integrase; l Chicoric acid; Ligand binding

Indexed keywords

ACIDS; BIOCHEMISTRY; CONFORMATIONS; DOCKING; ESTERIFICATION; ESTERS; EXPERIMENTS; ISOMERS; LIGANDS; NUCLEIC ACIDS; ORGANIC ACIDS; ORGANIC COMPOUNDS; VIRUSES;

AB INITIO; AM1; CONFORMATIONAL ANALYSIS; HIV-1 INTEGRASE; L-CHICORIC ACID; LIGAND BINDING;

BINDING ENERGY;

CICHORIC ACID; CIS TRANS ISOMERASE; ESTER DERIVATIVE; INTEGRASE;

AB INITIO CALCULATION; ARTICLE; BINDING AFFINITY; CHEMICAL INTERACTION; CHEMICAL STRUCTURE; CONFORMATION; MOLECULAR DOCKING; PRIORITY JOURNAL; PROTEIN INTERACTION;

CAFFEIC ACIDS; DRUG DESIGN; HIV INTEGRASE; HIV INTEGRASE INHIBITORS; HIV-1; HUMANS; MODELS, MOLECULAR; MOLECULAR STRUCTURE; PROTEIN BINDING; PROTEIN CONFORMATION; STEREOISOMERISM; SUCCINATES;

HUMAN IMMUNODEFICIENCY VIRUS 1;

EID: 57649176795     PISSN: 10933263     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jmgm.2008.09.011     Document Type: Article

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