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Modélisation de pharmacophores×Topologie de réseau d'interactions protéine-protéine×
DomaineBio-informatiqueBio-informatique
FamilleProcess / pipelineProcess / pipeline
Année d'origine19772000
Auteur d'originePeter GundPeter Uetz
TypePattern-based virtual screening pipelineNetwork analysis pipeline
Source fondatriceWermuth, C. G., Ganellin, C. R., Lindberg, P., & Mitscher, L. A. (1998). Glossary of terms used in medicinal chemistry. Pure and Applied Chemistry, 70(5), 1129-1143. DOI ↗Uetz, P., Giot, L., Cagney, G., Mansfield, T. A., Judson, R. S., Knight, J. R., ... & Lomax, J. (2000). A comprehensive analysis of protein-protein interactions in Saccharomyces cerevisiae. Nature, 403(6770), 623-627. DOI ↗
Aliaspharmacophore pattern recognition, 3D pharmacophoreprotein interaction networks, interactome analysis, network topology
Apparentées33
RésuméPharmacophore modeling identifies the spatial arrangement of molecular features (hydrogen bond donors, acceptors, aromatic rings) that are essential for biological activity. Introduced by Gund in 1977, this ligand-based method creates a three-dimensional pattern that can screen chemical libraries and design new active compounds without requiring receptor structure.Protein-protein interaction network analysis identifies and characterizes the structural properties of cellular interaction networks. Pioneered by Uetz and colleagues through large-scale yeast two-hybrid screening, this approach reveals topological features like hubs, modules, and motifs that encode functional organization and disease associations.
ScholarGateJeu de données
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ScholarGateComparer des méthodes: Pharmacophore Modeling · PPI Network Topology. Consulté le 2026-06-20 sur https://scholargate.app/fr/compare