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. 2018 Dec 10;149(22):224101. doi: 10.1063/1.5060960

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© 2018 Author(s).

0021-9606/2018/149(22)/224101/8/$0.00

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FIG. 3. — Comparison between the kinetic properties of MOR activation derived from MetaD and HTMD simulations. The mean first passage times (MFPTs) obtained for the most populated regions of the free-energy landscapes of morphine-induced MOR activation from (a) the MSMs built using the HTMD adaptive sampling runs and (b) the MaxCal MSMs built using the MetaD runs.