Compară metode

	Topologia rețelelor PPI	Docarea moleculară
Domeniu	Bioinformatică	Bioinformatică
Familie	Process / pipeline	Process / pipeline
Anul apariției	2000	1982
Autorul original	Peter Uetz	Irwin Kuntz
Tip	Network analysis pipeline	Binding prediction pipeline
Sursa seminală	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.	Kuntz, I. D., Blaney, J. M., Oatley, S. J., Langridge, R., & Ferrin, T. E. (1982). A geometric approach to macromolecule-ligand interactions. Journal of Molecular Biology, 161(2), 269-288.
Denumiri alternative	protein interaction networks, interactome analysis, network topology	protein-ligand docking, binding prediction
Înrudite	3	4
Rezumat	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.	Molecular docking predicts the preferred binding orientation and affinity of a ligand (small molecule) within a protein binding pocket. Pioneered by Kuntz and colleagues in 1982, this computational method searches conformational space to find energetically favorable ligand-protein complexes, enabling rapid screening of chemical libraries for drug discovery.