. 2014 Feb 18;10(4):1788–1794. doi: 10.1021/ct4010917

Table 5. Error (rmse relative to explicit solvent, in kcal/mol) in ΔG_pol Estimates Using CHA–GB and 3D-RISM.

	small molecules	amino acid analogs	proteins
CHA–GB	0.88	0.81	8.95
3D-RISM	0.50	5.28	18.36

Table 5. Error (rmse relative to explicit solvent, in kcal/mol) in ΔGpol Estimates Using CHA–GB and 3D-RISM.