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Snapshots from the MD simulation of the VX-hAChE:RS-170B complex revealing translational and conformational changes that bring the oxime within a reactive pose (green) and subsequently to an unproductive one (purple), after which the oxime is able to leave the active site. RS-170B colored in blue corresponds to a snapshot at 2 ns, green at 11 ns, red at 19 ns, and purple at 22 ns.
