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Exploring the Inhibitory Efficacy of Resokaempferol and Tectochrysin on PI3Kα Protein by Combining DFT and Molecular Docking against Wild-Type and H1047R Mutant Forms

This study explores the inhibitory potential of the flavonoids resokaempferol and tectochrysin against both wild-type and H1047R mutant forms of PI3Kα, aiming to expand the repertoire of targeted cancer therapies. Employing an array of computational techniques, including Density Functional Theory (D...

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Principais autores: Cristina Paraschiv, Steluța Gosav, Catalina Mercedes Burlacu, Mirela Praisler
Format: Artigo
Sprog:Inglês
Udgivet: MDPI AG 2024-09-01
Serier:Inventions
Fag:
flavonoid
PIK3CA
PI3Kα
H1047R
cognate docking
cross-docking
Online adgang:https://www.mdpi.com/2411-5134/9/5/96
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