Table 4. Statistical parameters of GH score validation for Hypo 1.
Parameter | Results |
---|---|
Total molecules in database (D) | 800 |
Total number of actives in database (A) | 43 |
Total Hits (Ht) | 49 |
Active Hits (Ha) | 39 |
% Yield of actives[(Ha/Ht)×100] | 79.59 |
% Ratio of actives [(Ha/A)×100] | 90.70 |
Enrichment factor (E) [(Ha×D)/(Ht×A)] | 14.81 |
False negatives [A-Ha] | 4.00 |
False positives [Ht-Ha] | 10.00 |
Goodness of Hit Score (GH)a | 0.81 |
a [(Ha/4HtA) (3A+Ht)×(1−(Ht-Ha)/(D−A))]