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ReverseDock: a web server for blind docking of a single ligand to multiple protein targets using AutoDock Vina

Several platforms exist to perform molecular docking to computationally predict binders to a specific protein target from a library of ligands. The reverse, that is, docking a single ligand to various protein targets, can currently be done by very few web servers, which limits the search to a small...

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Detalles Bibliográficos
Autores principales: Krause, Fabian, Voigt, Karsten, Di Ventura, Barbara, Öztürk, Mehmet Ali
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10594994/
https://www.ncbi.nlm.nih.gov/pubmed/37881441
http://dx.doi.org/10.3389/fmolb.2023.1243970