Identification of ligands for RNA targets via structure-based virtual screening: HIV-1 TAR

Journal of Computer-Aided Molecular Design

Volumn 14, Issue 6, 2000, Pages 593-610

  Filikov, Anton V ^a,d   Mohan, Venkatraman ^b   Vickers, Timothy A ^b   Griffey, Richard H ^b   Cook, P Dan ^b   Abagyan, Ruben A ^c   James, Thomas L ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b ISIS PHARMACEUTICALS   (United States)

^c LLC   (United States)

^d Xencor Inc   (United States)

Author keywords

Binding free energy; Molecular docking; RNA structure; Scintillation proximity assay; Structure based ligand design

Indexed keywords

AMINO ACIDS; BINDING ENERGY; FREE ENERGY; RNA; TAR;

BINDING FREE ENERGY; FREE ENERGY FUNCTION; LIGAND DESIGN; MOLECULAR DOCKING; RNA STRUCTURES; SCINTILLATION PROXIMITY ASSAY; STRUCTURE-BASED; STRUCTURE-BASED LIGAND DESIGN; TAT PROTEIN; VIRTUAL SCREENING;

LIGANDS;

AMINOGLYCOSIDE; ARGININE; GENTAMICIN; KANAMYCIN; LIGAND; LIVIDOMYCIN; NEAMINE; NEOMYCIN; PAROMOMYCIN; SISOMICIN; STREPTOMYCIN; TOBRAMYCIN; TRANSACTIVATOR PROTEIN; VIRUS RNA;

ARTICLE; BINDING AFFINITY; CHEMICAL STRUCTURE; CONTROLLED STUDY; DATA BASE; DRUG DESIGN; ENERGY; ENTROPY; HUMAN IMMUNODEFICIENCY VIRUS 1; ISOMERISM; LIGAND BINDING; PRIORITY JOURNAL; PROTEIN RNA BINDING; RNA STRUCTURE; SCREENING; SOLVATION;

EID: 0033949057     PISSN: 0920654X     EISSN: None     Source Type: Journal    
DOI: 10.1023/A:1008121029716     Document Type: Article

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