Development of a novel virtual screening cascade protocol to identify potential trypanothione reductase inhibitors.
about
Structure-based virtual screening for drug discovery: a problem-centric reviewDihydroquinazolines as a Novel Class of Trypanosoma brucei Trypanothione Reductase Inhibitors: Discovery, Synthesis, and Characterization of their Binding Mode by Protein CrystallographyNon-peptidic cruzain inhibitors with trypanocidal activity discovered by virtual screening and in vitro assaySoftware and resources for computational medicinal chemistryVirtual Screening and Molecular Dynamics Simulations from a Bank of Molecules of the Amazon Region Against Functional NS3-4A Protease-Helicase Enzyme of Hepatitis C Virus.Analysis of structure-based virtual screening studies and characterization of identified active compounds.Integrating sampling techniques and inverse virtual screening: toward the discovery of artificial peptide-based receptors for ligands.Induction of oxidative stress in Trypanosoma brucei by the antitrypanosomal dihydroquinoline OSU-40.Statistical analysis, optimization, and prioritization of virtual screening parameters for zinc enzymes including the anthrax toxin lethal factor.Challenges and advances in computational docking: 2009 in review.State of the art in African trypanosome drug discovery.Synthetic Medicinal Chemistry in Chagas' Disease: Compounds at The Final Stage of "Hit-To-Lead" Phase.Essential gene identification and drug target prioritization in Leishmania species.Development of an ex vivo lymph node explant model for identification of novel molecules active against Leishmania major.Probing the dimerization interface of Leishmania infantum trypanothione reductase with site-directed mutagenesis and short peptides.A new approach for potential drug target discovery through in silico metabolic pathway analysis using Trypanosoma cruzi genome information.Screening natural products database for identification of potential antileishmanial chemotherapeutic agents.Pocket detection and interaction-weighted ligand-similarity search yields novel high-affinity binders for Myocilin-OLF, a protein implicated in glaucoma.Footprinting of inhibitor interactions of in silico identified inhibitors of trypanothione reductase of Leishmania parasite.
P2860
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P2860
Development of a novel virtual screening cascade protocol to identify potential trypanothione reductase inhibitors.
description
2009 nî lūn-bûn
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2009 թուականի Մարտին հրատարակուած գիտական յօդուած
@hyw
2009 թվականի մարտին հրատարակված գիտական հոդված
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2009年の論文
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2009年論文
@yue
2009年論文
@zh-hant
2009年論文
@zh-hk
2009年論文
@zh-mo
2009年論文
@zh-tw
2009年论文
@wuu
name
Development of a novel virtual ...... nothione reductase inhibitors.
@ast
Development of a novel virtual ...... nothione reductase inhibitors.
@en
type
label
Development of a novel virtual ...... nothione reductase inhibitors.
@ast
Development of a novel virtual ...... nothione reductase inhibitors.
@en
prefLabel
Development of a novel virtual ...... nothione reductase inhibitors.
@ast
Development of a novel virtual ...... nothione reductase inhibitors.
@en
P2093
P2860
P356
P1476
Development of a novel virtual ...... nothione reductase inhibitors.
@en
P2093
Asdrubal Burgos
Deuan C Jones
Hortensia Rodriguez
Lena C Andrew
Margarita Suarez
Rolando Perez-Pineiro
P2860
P304
P356
10.1021/JM801306G
P407
P577
2009-03-01T00:00:00Z