Table 6.

Refined complexes of FireDock.

Rank	Solution number	Global energy (kcal/mol)	Attractive Van der Waals	Repulsive Van dar Waals	Atomic contact energy (kcal/mol)	Hydrogen bonding
1	3	−24.02	−38.57	28.88	11.49	−4.00
2	7	−18.39	−25.30	19.27	−2.78	−1.87
3	10	−8.94	−21.98	11.85	4.64	−1.22
4	4	−8.93	−15.55	6.26	1.15	−1.13
5	9	−6.05	−6.53	1.51	−2.06	0.00
6	6	−3.57	−17.34	10.10	0.14	−0.98
7	5	5.95	−11.60	14.02	3.33	0.00
8	8	13.59	−4.79	1.11	1.08	−1.43
9	1	17.90	−8.84	28.80	1.84	−1.58
10	2	2825.46	−44.83	3622.84	−0.61	−5.55