Novel computational and drug design strategies for inhibition of human papillomavirus-associated cervical cancer and DNA polymerase theta receptor by Apigenin derivatives

Novel computational and drug design strategies for inhibition of human papillomavirus-associated cervical cancer and DNA polymerase theta receptor by Apigenin derivatives

Abstract The present study deals with the advanced in-silico analyses of several Apigenin derivatives to explore human papillomavirus-associated cervical cancer and DNA polymerase theta inhibitor properties by molecular docking, molecular dynamics, QSAR, drug-likeness, PCA, a dynamic cross-correlati...

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Bibliographic Details
Main Authors: Shopnil Akash, Imren Bayıl, Md. Saddam Hossain, Md. Rezaul Islam, Md. Eram Hosen, Amare Bitew Mekonnen, Hiba-Allah Nafidi, Yousef A. Bin Jardan, Mohammed Bourhia, Talha Bin Emran
Format: Article
Language:English
Published: Nature Portfolio 2023-10-01
Series:Scientific Reports
Online Access:https://doi.org/10.1038/s41598-023-43175-x

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https://doi.org/10.1038/s41598-023-43175-x

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