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Target-Based Virtual Screening of Natural Compounds Identifies a Potent Antimalarial With Selective Falcipain-2 Inhibitory Activity

We employed a comprehensive approach of target-based virtual high-throughput screening to find potential hits from the ZINC database of natural compounds against cysteine proteases falcipain-2 and falcipain-3 (FP2 and FP3). Molecular docking studies showed the initial hits showing high binding affin...

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Detalles Bibliográficos
Autores principales:	Uddin, Amad, Gupta, Sonal, Mohammad, Taj, Shahi, Diksha, Hussain, Afzal, Alajmi, Mohamed F., El-Seedi, Hesham R., Hassan, Imtaiyaz, Singh, Shailja, Abid, Mohammad
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Frontiers Media S.A. 2022
Materias:	Pharmacology
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9020225/ https://www.ncbi.nlm.nih.gov/pubmed/35462917 http://dx.doi.org/10.3389/fphar.2022.850176

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