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Combined 3D-QSAR, molecular docking, ADMET, and drug-likeness scoring of novel diaminodihydrotriazines as potential antimalarial agents

Plasmodium falciparum dihydrofolate reductase (PfDHFR) is a promising therapeutic target for antimalarial interventions. Diaminodihydrotriazine derivatives have demonstrated their efficacy as antimalarial agents by targeting PfDHFR inhibition. In this study, we used a multifaceted approach including...

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Principais autores: Nedjla Khelfa, Salah Belaidi, Oussama Abchir, Imane Yamari, Samir Chtita, Abdelouahid Samadi, Muneerah Mogren Al-Mogren, Majdi Hochlaf
Format: Artigo
Sprog:Inglês
Udgivet: Elsevier 2024-06-01
Serier:Scientific African
Fag:
Diaminodihydrotriazine
PfDHFR
3D-QSAR
ADMET
Molecular docking
Online adgang:http://www.sciencedirect.com/science/article/pii/S2468227624001480
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