Toward wide-spectrum antivirals against coronaviruses: Molecular characterization of SARS-CoV-2 NSP13 helicase inhibitors

Abstract

Molecular dynamics simulations are used to unravel the SARS-CoV-2 NSP13 behavior in interaction with natural ligands and inhibitors.

Document Details

Document Type
Pub Defense Publication
Publication Date
Jan 07, 2022
Source ID
10.1126/sciadv.abj4526

Entities

People

  • Cintia A Menéndez
  • Fabian Byléhn
  • Gustavo R Perez-Lemus
  • Juan J. de Pablo
  • Walter Alvarado

Organizations

  • Argonne National Laboratory
  • Universidad Nacional del Sur
  • University of Chicago

Tags

Fields of Study

  • Chemistry
  • Physics