Antivirals virtual screening to SARS-CoV-2 non-structural proteins-Reference-Cited by-同舟云学术

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Antivirals virtual screening to SARS-CoV-2 non-structural proteins

Published:2021-05-05 Issue: Volume: Page:1-15
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Nunes Vinicius S.¹,Paschoal Diego F. S.²,Costa Luiz Antônio S.¹,Santos Hélio F. Dos¹

Affiliation:

1. NEQC: Núcleo de Estudos em Química Computacional, Departamento de Química, Universidade Federal de Juiz de Fora, Juiz de Fora, MG, Brasil

2. NQTCM: Núcleo de Química Teórica e Computacional de Macaé, Polo Ajuda, Universidade Federal do Rio de Janeiro, Macaé, RJ, Brasil

Funder

Fundação de Amparo à Pesquisa do Estado de Minas Gerais

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2021.1921033

Reference55 articles.

1. Pharmacoinformatics and molecular dynamics simulation studies reveal potential covalent and FDA-approved inhibitors of SARS-CoV-2 main protease 3CLpro

2. COVID‐2019: The role of the nsp2 and nsp3 in its pathogenesis

3. Drug Interactions with the Direct-Acting Antiviral Combination of Ombitasvir and Paritaprevir-Ritonavir

4. Molecular dynamics with coupling to an external bath

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1. First report on the QSAR modelling and multistep virtual screening of the inhibitors of nonstructural protein Nsp14 of SARS-CoV-2: Reducing unnecessary chemical synthesis and experimental tests;Arabian Journal of Chemistry;2024-03

2. Artificial intelligence-aiding lab-on-a-chip workforce designed oral [3.1.0] bi and [4.2.0] tricyclic catalytic interceptors inhibiting multiple SARS-CoV-2 protomers assisted by double-shell deep learning;RSC Advances;2024

3. Looking for SARS-CoV-2 Therapeutics Through Computational Approaches;Current Medicinal Chemistry;2023-08

4. Methodology-Centered Review of Molecular Modeling, Simulation, and Prediction of SARS-CoV-2;Chemical Reviews;2022-05-20

5. Combination Therapy of Ledipasvir and Itraconazole in the Treatment of COVID-19 Patients Coinfected with Black Fungus: An In Silico Statement;BioMed Research International;2022-04-19

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