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. 2022 Jul 15;23(14):7832. doi: 10.3390/ijms23147832

Figure 11.

Figure 11

The comparison of accuracy of COSMO-RS computed solubilities of caffeine in neat and binary solutions with experimental data. Additionally, two COSMO-RS-DARE extensions were included, namely first one resulting from the full optimization and the second one corresponding to Gint expressed as split linear functions with values documented in Table 2.