Fenugreek-derived bioactive compounds as high-affinity inhibitors of Monkeypox virus identified by integrated molecular docking, dynamics simulations, and ADMET profiling of promising candidates.

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Title: Fenugreek-derived bioactive compounds as high-affinity inhibitors of Monkeypox virus identified by integrated molecular docking, dynamics simulations, and ADMET profiling of promising candidates.
Authors: Hamadou, Mamoudou1,2 mamoudhmd@gmail.com, Bayiha ba Njock, Gaetan3, Abubakar, Abdulhalim Musa4, Saqib, Muhammad5, Batool, Shabana5, Adissa, Raimi Mouhamed Zakiou Kolawole6, Pegnyemb, Dieudonné Emmanuel7, Mune Mune, Martin Alain1,8
Source: Discover Chemistry. 7/8/2026, Vol. 3 Issue 1, p1-47. 47p.
Database: Academic Search Ultimate
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DOI:10.1007/s44371-026-00844-w