Table 3.
The distribution of absolute errors on the validation set in kJ/mol for the three Nutmeg models.
| Small | Medium | Large | |
|---|---|---|---|
| Mean | 2.60 | 2.19 | 1.85 |
| 50th percentile | 1.71 | 1.50 | 1.28 |
| 90th percentile | 5.67 | 4.68 | 3.87 |
| 99th percentile | 13.54 | 10.66 | 9.24 |
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