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In Silico Screening of the DrugBank Database to Search for Possible Drugs against SARS-CoV-2

Coronavirus desease 2019 (COVID-19) is responsible for more than 1.80 M deaths worldwide. A Quantitative Structure-Activity Relationships (QSAR) model is developed based on experimental pIC(50) values reported for a structurally diverse dataset. A robust model with only five descriptors is found, wi...

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Bibliografske podrobnosti
izdano v:Molecules
Main Authors: Cuesta, Sebastián A., Mora, José R., Márquez, Edgar A.
Format: Artigo
Jezik:Inglês
Izdano: MDPI 2021
Teme:
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC7923184/
https://ncbi.nlm.nih.gov/pubmed/33669720
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26041100
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