Computational Analysis of the SARS-CoV-2 RBD-ACE2-Binding Process Based on MD and the 3D-RISM Theory.
Norio YoshidaYutaka MaruyamaAyori MitsutakeAkiyoshi KurodaRyo FujikiKodai KanemaruDaisuke OkamotoAlexander E. KobrynSergey GusarovHaruyuki NakanoPublished in: J. Chem. Inf. Model. (2022)