Figure 5 | Scientific Reports

Figure 5

From: Bell-Evans model and steered molecular dynamics in uncovering the dissociation kinetics of ligands targeting G-protein-coupled receptors

Figure 5

Variation of the bootstrap statistics, (a) and (b), the average maximum unbinding force (FRmax) and, (c) and (d), standard deviation (FRmax σ) are shown as a function of number of replicas for the ligands ZMA241385 (black) and NECA (gray). The representative FRmax values used for the bootstrapping analysis were extracted from the SMD simulations at a pulling velocity of 0.0010 nm/ps. The error bars for the, (a) and (b), average FRmax values are the FRmax σ values.

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