Table 3.

Docking energy of AZD3293 against BACE1.

Docking Poses	Binding energy (Kcal/mol)	Intermol. energy (Kcal/mol)	Internal energy (Kcal/mol)	Torsional energy (Kcal/mol)	Unbound energy (Kcal/mol)
Docking Pose-1	−4.41	−6.50	−0.69	2.09	−0.69
Docking Pose-2	−4.87	−6.96	−0.37	2.09	−0.37
Docking Pose-3	−3.58	−5.67	−0.7	2.09	−0.7
Docking Pose-4	−4.79	−6.88	−0.5	2.09	−0.5
Docking Pose-5	−4.03	−6.12	−0.67	2.09	−0.67
Docking Pose-6	−4.42	−6.51	−0.71	2.09	−0.71
Docking Pose-7	−4.08	−6.17	−0.71	2.09	−0.71
Docking Pose-8	−5.33	−7.42	−0.64	2.09	−0.64
Docking Pose-9	−4.49	−6.58	−0.54	2.09	−0.54
Docking Pose-10	−3.71	−5.80	−0.65	2.09	−0.65