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In silico ADMET and molecular docking study on searching potential inhibitors from limonoids and triterpenoids for COVID-19

Virtual screening of phytochemicals was performed through molecular docking, simulations, in silico ADMET and drug-likeness prediction to identify the potential hits that can inhibit the effects of SARS-CoV-2. Considering the published literature on medicinal importance, 154 phytochemicals with anal...

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Detalhes bibliográficos
Publicado no:Comput Biol Med
Main Authors: Vardhan, Seshu, Sahoo, Suban K.
Formato: Artigo
Idioma:Inglês
Publicado em: Elsevier Ltd. 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7386496/
https://ncbi.nlm.nih.gov/pubmed/32738628
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.compbiomed.2020.103936
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