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Author

Arpita Robel Khamle

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Sep 2026

Mechanistic insights into Mfd inhibition by pharmacophore-guided ligands using molecular and steered molecular dynamics simulations.

Computational evidence is provided supporting a proposed mechanism linking this effect to inhibition of Mfd-mediated DNA repair and demonstrates how pharmacophore-guided computational approaches can provide a computational framework for identifying potential ATP-competitive Mfd inhibitors against antimicrobial resistan...

Varshini Dayanand Kore, Abhishek Lakhera, Arpita Robel Khamle et al. · 0 citations

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