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. 2016 Oct 3;2016:4182595. doi: 10.1155/2016/4182595

Table 1.

The validation results of the pharmacophore models.

Hypo Feature Rank A D Ha Ht HRA IEI CAI
1 RHHA Ev5 146.041 71 284 71 193 100.00% 1.47 1.47
2 RHHA Ev5 139.068 71 284 71 195 100.00% 1.46 1.46
3 RHHA Ev5 139.068 71 284 71 202 100.00% 1.41 1.41
4 HHAA Ev5 138.882 71 284 71 190 100.00% 1.50 1.50
5 HHAA Ev5 135.055 71 284 69 175 97.18% 1.58 1.53
6 RHHA Ev5 133.328 71 284 71 205 100.00% 1.39 1.39
7 RHHA Ev5 132.828 71 284 68 155 95.77% 1.75 1.68
8 RHHA Ev5 131.732 71 284 71 210 100.00% 1.35 1.35
9 HHAA Ev5 127.370 71 284 68 139 95.77% 1.96 1.87
10 RHHA Ev5 125.768 71 284 71 164 100.00% 1.73 1.73

A is the number of active compounds in the test set. D is the total number of compounds in test set. Ha is the number of active hits using pharmacophore to search. Ht is the number of hits using pharmacophore to search. HRA indicates the capability to recognize active molecules from the test set. IEI indicates the capability to recognize active molecules from nonactive molecules. CAI is the comprehensive appraisal index.