Table 2.
Fraction of test structures that were successfully predicted.
| Organic | Metal-Organic | |
|---|---|---|
|
| ||
| COSMOS (Free library) | 99% | 90% |
| Open Babel (OB library) | 98% | 85% |
| RDKit | 88% | 23% |
| Balloon | 89% | 58% |
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