Quantum Chemical Interaction Analysis between SARS-CoV-2 Main Protease and Ensitrelvir Compared with Its Initial Screening Hit

Autor: Chiduru Watanabe, Shigenori Tanaka, Yoshio Okiyama, Hitomi Yuki, Tatsuya Ohyama, Kikuko Kamisaka, Daisuke Takaya, Kaori Fukuzawa, Teruki Honma
Rok vydání: 2023
Předmět:
Zdroj: The Journal of Physical Chemistry Letters. 14:3609-3620
ISSN: 1948-7185
DOI: 10.1021/acs.jpclett.2c03768
Databáze: OpenAIRE