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A dynamic model of HIV integrase inhibition and drug resistance.

A dynamic model of HIV integrase inhibition and drug resistance.

http://www.wikidata.org/entity/Q33758191

about

Designing modulators of monoamine transporters using virtual screening techniques Blind prediction of HIV integrase binding from the SAMPL4 challenge Ligand Access to the Active Site in Thermus thermophilus ba 3 and Bovine Heart aa 3 Cytochrome Oxidases Structural Basis of Mos1 Transposase Inhibition by the Anti-retroviral Drug Raltegravir Structure-analysis of the HIV-1 integrase Y143C/R raltegravir resistance mutation in association with the secondary mutation T97A Oroxylin A inhibits hemolysis via hindering the self-assembly of α-hemolysin heptameric transmembrane pore Virtual screening of integrase inhibitors by large scale binding free energy calculations: the SAMPL4 challenge.Bicyclic hydroxy-1H-pyrrolopyridine-trione containing HIV-1 integrase inhibitors.Structure-based modeling of the functional HIV-1 intasome and its inhibition Computer-aided drug-discovery techniques that account for receptor flexibility.Molecular recognition in the case of flexible targets.Probing chelation motifs in HIV integrase inhibitors Bicyclic 1-hydroxy-2-oxo-1,2-dihydropyridine-3-carboxamide-containing HIV-1 integrase inhibitors having high antiviral potency against cells harboring raltegravir-resistant integrase mutants.Biomolecularmodeling and simulation: a field coming of age.Molecular dynamics of HIV1-integrase in complex with 93del - a structural perspective on the mechanism of inhibition.Virtual screening with AutoDock Vina and the common pharmacophore engine of a low diversity library of fragments and hits against the three allosteric sites of HIV integrase: participation in the SAMPL4 protein-ligand binding challenge Fisetin inhibits Listeria monocytogenes virulence by interfering with the oligomerization of listeriolysin O.Molecular dynamics simulation studies of the wild type and E92Q/N155H mutant of Elvitegravir-resistance HIV-1 integrase.Molecular dynamics simulation studies of the wild type and E92Q/N155H mutant of Elvitegravir-resistance HIV-1 integrase.Stabilization of the integrase-DNA complex by Mg2+ ions and prediction of key residues for binding HIV-1 integrase inhibitors.Raltegravir flexibility and its impact on recognition by the HIV-1 IN targets.Study on the interactions between diketo-acid inhibitors and prototype foamy virus integrase-DNA complex via molecular docking and comparative molecular dynamics simulation methods.Understanding the effect of drug-resistant mutations of HIV-1 intasome on raltegravir action through molecular modeling study.

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A dynamic model of HIV integrase inhibition and drug resistance.

http://www.wikidata.org/entity/Q33758191

description

2010 nî lūn-bûn

@nan

2010 թուականի Յունուարին հրատարակուած գիտական յօդուած

@hyw

2010 թվականի հունվարին հրատարակված գիտական հոդված

@hy

2010年の論文

@ja

2010年学术文章

@wuu

2010年学术文章

@zh-cn

2010年学术文章

@zh-hans

2010年学术文章

@zh-my

2010年学术文章

@zh-sg

2010年學術文章

@yue

name

A dynamic model of HIV integrase inhibition and drug resistance.

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A dynamic model of HIV integrase inhibition and drug resistance.

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type

label

A dynamic model of HIV integrase inhibition and drug resistance.

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A dynamic model of HIV integrase inhibition and drug resistance.

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prefLabel

A dynamic model of HIV integrase inhibition and drug resistance.

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A dynamic model of HIV integrase inhibition and drug resistance.

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J.JMB.2010.01.033

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Journal of Molecular Biology

P1476

A dynamic model of HIV integrase inhibition and drug resistance.

@en

P2093

Alex L Perryman

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Arthur J Olson

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Catherine Burt

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Chris Phillips

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Kevin Whitby

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Michael J Palmer

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Stefano Forli

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Yuhui Cheng

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P2860

The mobility of an HIV-1 integrase active site loop is correlated with catalytic activity

Structure of the HIV-1 integrase catalytic domain complexed with an inhibitor: a platform for antiviral drug design

Binding of different divalent cations to the active site of avian sarcoma virus integrase and their effects on enzymatic activity

Crystal structures of the catalytic domain of HIV-1 integrase free and complexed with its metal cofactor: high level of similarity of the active site with other viral integrases

Structure validation by Calpha geometry: phi,psi and Cbeta deviation

Comparison of multiple Amber force fields and development of improved protein backbone parameters

Inhibitors of strand transfer that prevent integration and inhibit HIV-1 replication in cells

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

A semiempirical free energy force field with charge-based desolvation

Python: a programming language for software integration and development

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600-615

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scholarly article

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10.1016/J.JMB.2010.01.033

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2

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397

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Garrett M. Morris

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2010-01-22T00:00:00Z

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