Research Article
Discovery of Potential Orthosteric and Allosteric Antagonists of P2Y1R from Chinese Herbs by Molecular Simulation Methods
Table 3
Twelve GALAHAD models selected based on N_Hits.
| N_Hits Model | N_Hits | Specificity | Energy | Pareto |
| O-12 | 7 | 2.37 | 41.35 | 0 | O-06 | 7 | 1.95 | 22860.18 | 0 | O-11 | 6 | 0.84 | 0.80 | 0 | O-05 | 6 | 1.82 | −0.30 | 0 | O-20 | 6 | 2.18 | 0.12 | 0 | O-18 | 6 | 1.77 | −0.52 | 0 | O-16 | 6 | 1.44 | 0.45 | 0 | O-14 | 6 | 2.50 | −0.05 | 0 | O-15 | 6 | 3.72 | 2134232.75 | 0 | O-01 | 6 | 2.30 | 12.39 | 0 |
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