Ligand selectivity and competition between enzymes in silico.
about
Structure-based activity prediction for an enzyme of unknown functionDiscovery of a dipeptide epimerase enzymatic function guided by homology modeling and virtual screeningCovalent docking predicts substrates for haloalkanoate dehalogenase superfamily phosphatasesDistribution patterns of small-molecule ligands in the protein universe and implications for origin of life and drug discoveryLocalization of binding sites in protein structures by optimization of a composite scoring functionMolecular signatures-based prediction of enzyme promiscuity.Evaluation of an inverse molecular design algorithm in a model binding siteModelling substrate specificity and enantioselectivity for lipases and esterases by substrate-imprinted docking.Studying enzyme-substrate specificity in silico: a case study of the Escherichia coli glycolysis pathwayNetwork-level architecture and the evolutionary potential of underground metabolism.Divergent evolution in enolase superfamily: strategies for assigning functionsPrediction methods and databases within chemoinformatics: emphasis on drugs and drug candidates.Cohesion group approach for evolutionary analysis of TyrA, a protein family with wide-ranging substrate specificities.Computational molecular modeling for evaluating the toxicity of environmental chemicals: prioritizing bioassay requirements.Target flexibility: an emerging consideration in drug discovery and design.Physicochemical characteristics of structurally determined metabolite-protein and drug-protein binding events with respect to binding specificity.The evolution of biology. A shift towards the engineering of prediction-generating tools and away from traditional research practice.Identification and characterization of L-arabonate dehydratase, L-2-keto-3-deoxyarabonate dehydratase, and L-arabinolactonase involved in an alternative pathway of L-arabinose metabolism. Novel evolutionary insight into sugar metabolism.Prediction of enzymatic pathways by integrative pathway mapping.Genome-wide analysis of substrate specificities of the Escherichia coli haloacid dehalogenase-like phosphatase family.Catalytic promiscuity in dihydroxy-acid dehydratase from the thermoacidophilic archaeon Sulfolobus solfataricus.Docking-based inverse virtual screening: methods, applications, and challenges.
P2860
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P2860
Ligand selectivity and competition between enzymes in silico.
description
2004 nî lūn-bûn
@nan
2004年の論文
@ja
2004年学术文章
@wuu
2004年学术文章
@zh-cn
2004年学术文章
@zh-hans
2004年学术文章
@zh-my
2004年学术文章
@zh-sg
2004年學術文章
@yue
2004年學術文章
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2004年學術文章
@zh-hant
name
Ligand selectivity and competition between enzymes in silico.
@en
Ligand selectivity and competition between enzymes in silico.
@nl
type
label
Ligand selectivity and competition between enzymes in silico.
@en
Ligand selectivity and competition between enzymes in silico.
@nl
prefLabel
Ligand selectivity and competition between enzymes in silico.
@en
Ligand selectivity and competition between enzymes in silico.
@nl
P2860
P50
P356
P1433
P1476
Ligand selectivity and competition between enzymes in silico.
@en
P2860
P2888
P304
P356
10.1038/NBT999
P577
2004-08-01T00:00:00Z
P5875
P6179
1051783907