De novo design of novel protease inhibitor candidates in the treatment of SARS-CoV-2 using deep learning, docking, and molecular dynamic simulations
Author:
Funder
Shiraz University
China Scholarship Council
Publisher
Elsevier BV
Subject
Health Informatics,Computer Science Applications
Reference50 articles.
1. Ongoing COVID-19 pandemic: a concise but updated comprehensive review;Wang;Curr. Microbiol.,2021
2. Prevention Centers for Disease Control and. Novel Coronavirus,2019
3. Clinical features of patients infected with 2019 novel coronavirus in Wuhan, China;Huang;Lancet,2020
4. Anti-HCV, nucleotide inhibitors, repurposing against COVID-19;Elfiky;Life Sci.,2020
5. Coronavirus main proteinase (3CLpro) structure: basis for design of anti-SARS drugs;Anand;Science,2003
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