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. Author manuscript; available in PMC: 2022 Nov 14.
Published in final edited form as: Living J Comput Mol Sci. 2022 Aug 30;4(1):1497. doi: 10.33011/livecoms.4.1.1497

Figure 7. The larger the experimental uncertainty, the larger the affinity range required for a given Rmax2.

Figure 7.

Corresponding to Equation 4, the maximum achievable R2 for a given dataset is limited by the range of affinities and the associated experimental uncertainty. The illustration assumes that σ(measurement error) and σ(affinity) are in the same units, with an experimental error of 0.64 kcal mol−1 indicated.