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Computer-aided discovery of novel SmDHODH inhibitors for schistosomiasis therapy: Ligand-based drug design, molecular docking, molecular dynamic simulations, drug-likeness, and ADMET studies.
Ja'afaru SC, Uzairu A, Hossain S, Ullah MH, Sallau MS, Ndukwe GI, Ibrahim MT, Bayil I, Moin AT. Ja'afaru SC, et al. Among authors: sallau ms. PLoS Negl Trop Dis. 2024 Sep 12;18(9):e0012453. doi: 10.1371/journal.pntd.0012453. eCollection 2024 Sep. PLoS Negl Trop Dis. 2024. PMID: 39264908 Free PMC article.