Utilizing experimental data for reducing ensemble size in flexible-protein docking.
about
The Art of Compiling Protein Binding Site Ensembles.Enrichment of chemical libraries docked to protein conformational ensembles and application to aldehyde dehydrogenase 2Highly predictive ligand-based pharmacophore and homology models of ABHD6.Rational prediction with molecular dynamics for hit identificationKnowledge-Based Methods To Train and Optimize Virtual Screening Ensembles.Induced fit docking, and the use of QM/MM methods in dockingImprovements, trends, and new ideas in molecular docking: 2012-2013 in review.Protein Flexibility in Drug Discovery: From Theory to Computation.Understanding the challenges of protein flexibility in drug design.A cross docking pipeline for improving pose prediction and virtual screening performance.Sampling of conformational ensemble for virtual screening using molecular dynamics simulations and normal mode analysis.Enhancing Virtual Screening Performance of Protein Kinases with Molecular Dynamics SimulationsEfficient flexible backbone protein-protein docking for challenging targets
P2860
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P2860
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
description
2011 nî lūn-bûn
@nan
2011 թուականի Դեկտեմբերին հրատարակուած գիտական յօդուած
@hyw
2011 թվականի դեկտեմբերին հրատարակված գիտական հոդված
@hy
2011年の論文
@ja
2011年論文
@yue
2011年論文
@zh-hant
2011年論文
@zh-hk
2011年論文
@zh-mo
2011年論文
@zh-tw
2011年论文
@wuu
name
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@ast
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@en
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@nl
type
label
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@ast
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@en
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@nl
prefLabel
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@ast
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@en
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@nl
P2860
P356
P1476
Utilizing experimental data for reducing ensemble size in flexible-protein docking.
@en
P2093
Markus A Lill
Mengang Xu
P2860
P304
P356
10.1021/CI200428T
P577
2011-12-19T00:00:00Z