表 3. SMILESynergy regression performance metrics on NCI-ALMANAC.
SMILESynergy 在NCI-ALMANAC数据集上的回归性能指标
| 指标 | MAE | MSE | R2 | EVS | Pearson |
| 平均值 | 6.87 | 88.98 | 0.73 | 0.74 | 0.86 |
| 中位数 | 6.55 | 75.39 | 0.74 | 0.74 | 0.86 |
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