Identification of Bacterial Oligopeptidase B Inhibitors from Microbial Natural Products: Molecular Insights, Docking Studies, MD Simulations, and ADMET Predictions.

Pharmaceuticals (Basel) · 2025 · PMC12114661 · PMID 40430528

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highly significantno p-value reported

Moreover, a π-cation interaction with Phe586 (95%) was highly significant, reflecting the importance of this interaction in antipain’s binding.

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