过去一年中添加的文章，按日期排序

Diterpenoids with Targeting SARS-CoV-2 RdRp from the Roots of Euphorbia fischeriana Steud

T Ruan, Z Xiang, YW Zhang, S Fan, J Ren, Q Zhao… - Frontiers in Plant … - frontiersin.org
4 天前 - … Furthermore, with the aid of computer virtual screening and microscale
thermophoresis (MST) technology, it was found that this compound could directly bind to the RNA-…
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[HTML] indojournalpmr.org

[HTML][HTML] Cardiac Rehabilitation in Post COVID-19 Patients with Cardiovascular Diseases Complipication

DM Sari, A Khairunnisa, LCG Wijaya… - … Journal of Physical …, 2024 - indojournalpmr.org
8 天前 - … "Sars-Cov-2" OR "COVID-19" AND "Cardiovascular Diseases" AND "Cardiac
Rehabilitation" across various databases. After screening, … have shifted to virtual or telemedicine …
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09. Database development for components of African Traditional Medicine for the identification of antiviral compounds by virtual screening

JY Betow, BD Bekono, S Akame, LE Njume… - Part I: About the … - researchgate.net
13 天前 - … and their biological activities would be evaluated against different targets of
SARS-CoV-2 and HIV) or the discovery of synthetic routes toward secondary metabolites. …
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… discovery of dual potential inhibitors of SARS‐CoV‐2 spike/ACE2 and Mpro: 3D-pharmacophore, docking-based virtual screening, quantum mechanics and …

BD Bekono, PA Onguéné, CV Simoben… - European Biophysics …, 2024 - Springer
15 天前 - To find drugs against COVID-19, caused by the SARS-CoV-2, promising targets
include the fusion of the viral spike with the human angiotensin-converting enzyme 2 (ACE2) as …
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[HTML] nature.com

[HTML][HTML] Computational evaluation and benchmark study of 342 crystallographic holo-structures of SARS-CoV-2 Mpro enzyme

H Khachatryan, M Matevosyan, V Harutyunyan… - Scientific Reports, 2024 - nature.com
15 天前 - … influencing the performance of virtual screening in targeting SARS-CoV-2 Mpro.
Based on our results, several suggestions for improving virtual screening can be proposed. …
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Delineating Potential de novo Therapeutics and Repurposed Drugs Against Novel Protein LRRC15 to Treat SARS-CoV-2

M Afroj Zinnia, K Islam, ABM Md - Letters in Drug Design & …, 2024 - ingentaconnect.com
16 天前 - … against SARS-CoV-2. In this study, design some potential inhibitors against LRRC15.
… -based de novo drug generation, and virtual screening of three chemical libraries (ZINC …
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The Malaria Box molecules: a source for targeting the RBD and NTD cryptic pocket of the spike glycoprotein in SARS-CoV-2

K Otazu, GE Olivos-Ramirez… - Journal of Molecular …, 2024 - Springer
17 天前 - … We used all of these compounds for virtual screening tests. The compounds were
filtered based on the criteria established in Lipinski’s rule of five [32], selecting only those …
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[HTML] sciencedirect.com

[HTML][HTML] Baicalein Analogues as Prospective SARS-CoV-2 Main Protease (Mpro) Inhibitors: A Dataset of Molecular Docking-based Virtual Screening Hits

QJ Wong, ZH Low, ZY Chan, VR Avupati - Data in Brief, 2024 - Elsevier
23 天前 - … virtual screening procedure In the present study, molecular docking simulations-based
virtual screening … the selected target protein, which is SARS-COV-2 Main Protease (PDB: …
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[PDF] preprints.org

In Silico and In Vitro Studies of Terpenes from the Fabaceae Family Using the Phenotypic Screening Model against the SARS-CoV-2 Virus

NF de Sousa, GD Duarte, CB Moraes, CG Barbosa… - 2024 - preprints.org
24 天前 - … of SARS-CoV-2 inhibition along with substantial cell viability underwent Molecular
Docking at the SARS-CoV-2 … Overall, virtual screening through our QSAR model successfully …
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In Silico and In Vitro Studies of Terpenes from the Fabaceae Family Using the Phenotypic Screening Model against the SARS-CoV-2 Virus

S NFd, GD Duarte, CB Moraes, CG Barbosa, H Martin… - 2024 - europepmc.org
25 天前 - … virtual screening of terpenes with potential anti SARS-CoV-2 activity. To perform the
ligand-based virtual… already showed inhibitory activity of the SARS-CoV-2. The test series …
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