Screening of world approved drugs against highly dynamical spike glycoprotein of SARS-CoV-2 using CaverDock and machine learning-Reference-Cited by-同舟云学术

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Screening of world approved drugs against highly dynamical spike glycoprotein of SARS-CoV-2 using CaverDock and machine learning

Published:2021 Issue: Volume:19 Page:3187-3197
ISSN:2001-0370
Container-title:Computational and Structural Biotechnology Journal
language:en
Short-container-title:Computational and Structural Biotechnology Journal

Author:

Pinto Gaspar P.,Vavra Ondrej,Marques Sergio M.,Filipovic Jiri,Bednar David,Damborsky Jiri

Funder

European Commission

Ministerstvo Školství, Mládeže a Tělovýchovy

Grantová Agentura České Republiky

Masarykova Univerzita

Publisher

Elsevier BV

Subject

Computer Science Applications,Genetics,Biochemistry,Structural Biology,Biophysics,Biotechnology

Reference94 articles.

1. StatPearls;Cascella,2020

2. Care for critically ill patients with COVID-19;Murthy;JAMA,2020

3. Shindo and WHO scientific and technical advisory group for infectious hazards, COVID-19: what is next for public health?;Heymann;Lancet,2020

4. The continuing 2019-nCoV epidemic threat of novel coronaviruses to global health — the latest 2019 novel coronavirus outbreak in Wuhan, China;Hui;Int J Inf Dis,2020

5. Designing of improved drugs for COVID-19: Crystal structure of SARS-CoV-2 main protease M pro;Mengist;Signal Transd Targeted Therapy,2020

Cited by 11 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. An evaluation of spirooxindoles as blocking agents of SARS-CoV-2 spike/ACE2 fusion and M pro inhibitory agents: Synthesis, biological evaluation and computational analysis;2024-06-21

2. Machine Learning First Response to COVID-19: A Systematic Literature Review of Clinical Decision Assistance Approaches during Pandemic Years from 2020 to 2022;Electronics;2024-03-07

3. pyCaverDock: Python implementation of the popular tool for analysis of ligand transport with advanced caching and batch calculation support;Bioinformatics;2023-07-20

4. CLICK- chemoproteomics and molecular dynamics simulation reveals pregnenolone targets and their binding conformations in Th2 cells;2023-05-24

5. Large-scale Annotation of Biochemically Relevant Pockets and Tunnels in Cognate Enzyme-Ligand Complexes;2023-03-30

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