Table 1.

The hydration free energies from FreeformSolv, FreeformSolvNoSym, OmegaZap, and the experimental values in kcal/mol. The submission ID is given above the method name

SAMPL ID	565	566	561	Exp
	FreeformSolvNoSym	FreeformSolv	OmegaZAP
SAMPL4_001	−19.28	−19.40	−24.30	−23.62
SAMPL4_002	−2.70	−2.91	−3.47	−2.49
SAMPL4_003	−4.47	−4.49	−4.98	−4.78
SAMPL4_004	−4.58	−4.59	−5.04	−4.45
SAMPL4_005	−3.44	−3.43	−5.51	−5.33
SAMPL4_006	−4.96	−4.95	−5.13	−5.26
SAMPL4_009	−8.38	−8.89	−9.46	−8.24
SAMPL4_010	−5.21	−5.87	−5.34	−6.24
SAMPL4_011	−8.20	−8.15	−8.42	−7.78
SAMPL4_012	−2.77	−2.84	−2.88	−3.75
SAMPL4_013	−4.55	−4.66	−4.75	−4.44
SAMPL4_014	−3.75	−3.77	−3.88	−4.09
SAMPL4_015	−2.80	−2.89	−3.02	−4.51
SAMPL4_016	−2.97	−3.05	−3.07	−3.20
SAMPL4_017	−2.13	−2.25	−2.28	−2.53
SAMPL4_019	−2.92	−2.93	−3.05	−3.78
SAMPL4_020	−2.72	−2.75	−2.90	−2.78
SAMPL4_021	−9.19	−9.22	−9.17	−7.63
SAMPL4_022	−7.88	−7.91	−7.92	−6.78
SAMPL4_023	−6.24	−6.72	−6.74	−9.34
SAMPL4_024	−5.37	−5.56	−5.91	−7.43
SAMPL4_025	−4.40	−4.47	−4.43	−5.73
SAMPL4_026	−5.61	−5.69	−6.46	−5.31
SAMPL4_027	−2.72	−3.21	−3.56	−4.80
SAMPL4_028	−2.19	−2.61	−3.26	−4.29
SAMPL4_029	−0.11	−0.29	−0.68	−1.66
SAMPL4_030	−2.56	−2.55	−3.23	−2.29
SAMPL4_032	−5.77	−5.77	−5.63	−7.29
SAMPL4_033	−5.71	−6.41	−8.53	−6.96
SAMPL4_034	−5.40	−5.39	−5.58	−5.80
SAMPL4_035	−6.32	−6.32	−9.09	−4.68
SAMPL4_036	−5.42	−5.52	−5.52	−5.66
SAMPL4_037	−5.80	−5.78	−5.97	−5.94
SAMPL4_038	−4.71	−4.71	−4.81	−3.93
SAMPL4_039	−0.65	−0.67	−0.78	−0.85
SAMPL4_041	−3.43	−3.67	−3.65	−5.05
SAMPL4_042	−1.36	−1.50	−1.53	−3.13
SAMPL4_043	0.82	0.82	0.74	0.14
SAMPL4_044	−4.35	−4.21	−4.51	−5.08
SAMPL4_045	−12.34	−12.34	−13.18	−11.53
SAMPL4_046	−9.90	−10.25	−10.70	−9.44
SAMPL4_047	−13.37	−13.32	−13.62	−14.21
SAMPL4_048	−13.20	−13.90	−13.98	−11.85
SAMPL4_049	−4.18	−4.18	−4.48	−3.16
SAMPL4_050	−3.88	−3.88	−4.10	−4.14
SAMPL4_051	−10.58	−10.94	−16.38	−9.53
SAMPL4_052	−3.29	−3.29	−3.57	−2.87