Table 3. ΔΔG TYK2 RBFE-Statistics Summary of Estimate Errors and Correlation Metrics to Experiment¹⁰³ for Each Mapping Method and Network Type of the TYK2 System^a.

	radial			MST
network layout approach	Kartograf	2D Lomap	3D Lomap	Kartograf	2D Lomap	3D Lomap
RMSE (kcal/mol)	0.65 ± 0.13	0.69 ± 0.15	0.65 ± 0.14	0.90 ± 0.17	0.79 ± 0.14	0.92 ± 0.15
MUE (kcal/mol)	0.53 ± 0.11	0.54 ± 0.12	0.48 ± 0.12	0.72 ± 0.16	0.64 ± 0.13	0.76 ± 0.16
ρPears	0.72 ± 0.13	0.74 ± 0.11	0.78 ± 0.11	0.41 ± 0.29	0.65 ± 0.18	0.40 ± 0.29
τKendall	0.46 ± 0.18	0.57 ± 0.16	0.50 ± 0.17	0.14 ± 0.18	0.41 ± 0.20	0.21 ± 0.20

^aErrors in statistical estimates are calculated via bootstrap resampling.