Table II.

The size and composition of designed optimal inhibitor cocktails as a function of relative binding affinity cutoff (member inhibitor indices are represented in distinctive colors; calculations neglect inhibitor configurational entropy).

Cutoff (kcal/mol)	1	2	3	4	5	6	7	8	9	10
Cocktail Size	12	9	7	5	4	3	3	2	2	2
WT1	17220	17220	17138	7961	15170	4689	4689	13967	607	607
WT2	6898	6898	7961	7961	7961	7063	7063	13967	607	607
WT3	103	17138	17138	385	385	851	851	10300	10300	10300
WT4	8162	8162	8162	385	385	7063	7063	10300	10300	10300
I50V	8318	8318	5201	5201	851	851	851	13967	607	607
I84V	6547	6547	11091	7961	7961	4689	4689	13967	607	607
V82T,I84V	5355	17220	7961	7961	7961	4689	4689	13967	607	607
G48V	9003	9003	9003	385	385	7063	7063	10300	10300	10300
I54V	17220	17220	7961	7961	7961	4689	4689	13967	607	607
V82A	11091	6898	11091	5441	7961	4689	4689	13967	607	607
L90M	10627	10627	5201	5201	15170	4689	4689	13967	607	607
M1	6898	6898	7961	7961	7961	7063	7063	13967	607	607
D30N	4179	4179	4179	4179	15170	4689	4689	13967	607	607
M4	11288	17138	17138	5441	851	851	851	10300	10300	10300