AUTHOR=Castillo-Campos Luis , Velázquez-Libera José Luis , Caballero Julio 

TITLE=Computational study of the binding orientation and affinity of noncovalent inhibitors of the papain-like protease (PLpro) from SARS-CoV-1 considering the protein flexibility by using molecular dynamics and cross-docking

JOURNAL=Frontiers in Molecular Biosciences

VOLUME=10

YEAR=2023

URL=https://www.frontiersin.org/journals/molecular-biosciences/articles/10.3389/fmolb.2023.1215499

DOI=10.3389/fmolb.2023.1215499

ISSN=2296-889X