Supercomputing, Docking and Quantum Mechanics in Quest for Inhibitors of Papain-like Protease of SARS-CoV-2

被引：0
|
作者：
A. V. Sulimov
I. S. Ilin
D. C. Kutov
N. V. Stolpovskaya
Kh. S. Shikhaliev
V. B. Sulimov
机构：
[1] Research Computing Center of Lomonosov Moscow State University,
[2] Moscow Center of Fundamental and Applied Mathematics,undefined
[3] Department of Organic Chemistry,undefined
[4] Faculty of Chemistry,undefined
[5] Voronezh State University,undefined
来源：
Lobachevskii Journal of Mathematics | 2021年 / 42卷
关键词：
drug discovery; docking; quantum chemistry; inhibitors; PLpro; SARS-CoV-2; COVID-19; CADD;
D O I：
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中图分类号：
学科分类号：
摘要：
引用
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页码：1571 / 1579
页数：8
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