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Unexpected Single-Ligand Occupancy and Negative Cooperativity in the SARS-CoV-2 Main Protease.

Simone AlbaniElisa CostanziGia Linh HoangMaria KuzikovMarcus FringsNarjes AnsariNicola DemitriToan T. NguyenValerio RizziJörg B. SchulzCarsten BolmAndrea ZalianiPaolo CarloniPaola StoriciGiulia Rossetti
Published in: J. Chem. Inf. Model. (2024)
Keyphrases
  • drug design
  • case study
  • databases
  • drug discovery
  • quantitative structure activity