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Combining docking with pharmacophore filtering for improved virtual screening

Combining docking with pharmacophore filtering for improved virtual screening

http://www.wikidata.org/entity/Q27998704

about

Inhibitors of Helicobacter pylori protease HtrA found by 'virtual ligand' screening combat bacterial invasion of epithelia Identification of natural compound inhibitors for multidrug efflux pumps of Escherichia coli and Pseudomonas aeruginosa using in silico high-throughput virtual screening and in vitro validation Software and resources for computational medicinal chemistry Recent trends and observations in the design of high-quality screening collections.An integrated approach to knowledge-driven structure-based virtual screening.Reviewing ligand-based rational drug design: the search for an ATP synthase inhibitor.Azathioprine, Mercaptopurine, and 5-Aminosalicylic Acid Affect the Growth of IBD-Associated Campylobacter Species and Other Enteric Microbes Challenges and advances in computational docking: 2009 in review.Identification of novel potential HIF-prolyl hydroxylase inhibitors by in silico screening.

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P2860

Combining docking with pharmacophore filtering for improved virtual screening

http://www.wikidata.org/entity/Q27998704

description

2009 nî lūn-bûn

@nan

2009 թուականի Մայիսին հրատարակուած գիտական յօդուած

@hyw

2009 թվականի մայիսին հրատարակված գիտական հոդված

@hy

2009年の論文

@ja

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

Combining docking with pharmacophore filtering for improved virtual screening

@ast

Combining docking with pharmacophore filtering for improved virtual screening

@en

Combining docking with pharmacophore filtering for improved virtual screening

@nl

type

label

Combining docking with pharmacophore filtering for improved virtual screening

@ast

Combining docking with pharmacophore filtering for improved virtual screening

@en

Combining docking with pharmacophore filtering for improved virtual screening

@nl

prefLabel

Combining docking with pharmacophore filtering for improved virtual screening

@ast

Combining docking with pharmacophore filtering for improved virtual screening

@en

Combining docking with pharmacophore filtering for improved virtual screening

@nl

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Journal of Cheminformatics

P1476

Combining docking with pharmacophore filtering for improved virtual screening

@en

P2093

Megan L Peach

http://www.w3.org/2001/XMLSchema#string

P2860

BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities

Oxindole-based inhibitors of cyclin-dependent kinase 2 (CDK2): design, synthesis, enzymatic activities, and X-ray crystallographic analysis

Virtual screening for submicromolar leads of tRNA-guanine transglycosylase based on a new unexpected binding mode detected by crystal structure analysis

Imidazo[1,2-a]pyridines: a potent and selective class of cyclin-dependent kinase inhibitors identified through structure-based hybridisation

ZINC--a free database of commercially available compounds for virtual screening

Crystal structure of the cys2 activator-binding domain of protein kinase C delta in complex with phorbol ester

Structural evidence for a second sialic acid binding site in avian influenza virus neuraminidases

Development and validation of a genetic algorithm for flexible docking

Glide: a new approach for rapid, accurate docking and scoring. 1. Method and assessment of docking accuracy

A critical assessment of docking programs and scoring functions

P2888

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6

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scholarly article

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10.1186/1758-2946-1-6

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1

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1

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Marc C Nicklaus

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2009-05-20T00:00:00Z

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42344109

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1050659459

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20298524

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3152774

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