Table 1. Ranking of the selected hits using the MM-PBSA method compared to that of AutoDock.

#	MM-PBSA Rank	AutoDockRank	MM-PBSA BE (kcal/mol) ±0.5	LogP
1	1	185	−11.3	4.7
2	2	62	−11.0	3.4
3	5	139	−10.7	3.1
4	9	112	−9.9	4.4
5	4	63	−9.6	3.7
6	11	128	−9.3	3.3
7	13	59	−8.9	3.4
8	23	181	−8.2	2.7
9	29	138	−7.7	4.3
10	34	54	−7.4	2.6
11	37	131	−7.2	3.1
12	45	104	−7.0	2.5
13	46	44	−6.9	−0.1
14	47	129	−6.8	3.4