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. Author manuscript; available in PMC: 2019 Nov 13.
Published in final edited form as: J Chem Theory Comput. 2018 Oct 25;14(11):5797–5814. doi: 10.1021/acs.jctc.8b00413

Figure 5.

Figure 5.

2D histograms for each protein, showing fitted molecular SASA versus ICOSA numerical values for the test set. Perfect agreement is indicated by the diagonal dashed lines. The color indicates the kernel density estimated using scipy gaussian_kde73.