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Shape Complementarity Optimization of Antibody–Antigen Interfaces: The Application to SARS-CoV-2 Spike Protein

Many factors influence biomolecule binding, and its assessment constitutes an elusive challenge in computational structural biology. In this aspect, the evaluation of shape complementarity at molecular interfaces is one of the main factors to be considered. We focus on the particular case of antibod...

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Detalles Bibliográficos
Autores principales:	De Lauro, Alfredo, Di Rienzo, Lorenzo, Miotto, Mattia, Olimpieri, Pier Paolo, Milanetti, Edoardo, Ruocco, Giancarlo
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Frontiers Media S.A. 2022
Materias:	Molecular Biosciences
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9163568/ https://www.ncbi.nlm.nih.gov/pubmed/35669567 http://dx.doi.org/10.3389/fmolb.2022.874296

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