CheMeleon Descriptor-based Foundation Model (Chemrop 2.2.1)
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| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | LOG_RLM_CLint | r2 | 0.5704040552406642 |
| test | LOG_RLM_CLint | pearsonr | 0.7565486011942203 |
| test | LOG_RLM_CLint | spearmanr | 0.7618395513085777 |
| test | LOG_RLM_CLint | explained_var | 0.570720943514615 |
| test | LOG_RLM_CLint | mean_squared_error | 0.24252551920935045 |
| test | LOG_RLM_CLint | mean_absolute_error | 0.3930279070214669 |