Dynamic Mechanism of a Fluorinated Oxime Reactivator Unbinding from AChE Gorge in Polarizable Water

Pathak, A. K.Bandyopadhyay, T.2018-10-012018-10-012018Journal of Physical Chemistry-B, 2018. Vol. 122 (14): pp. 3876-3888http://hdl.handle.net/123456789/169854568 bytestext/htmlenDynamic MechanismFluorinated Oxime Reactivator UnbindingAChE GorgePolarizable Waterfluorinated oxime (FHI-6) drugwell-tempered metadynamics simulationDynamic Mechanism of a Fluorinated Oxime Reactivator Unbinding from AChE Gorge in Polarizable WaterArticle