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. 2021 Jul 13;17(8):5379–5391. doi: 10.1021/acs.jctc.1c00374

Figure 6.

Figure 6

Difference between the C2 and IE entropies as a function of σIE for our previous MM/GBSA studies (raw data in Table 1). The inset shows the results with σIE < 16 kJ/mol.