Bounded live-route maintenance test for Crystal-Likeness Score (PU-CGCNN). Includes a validated diamond-Si control and a deliberately truncated CIF edge case; observations are from the production Ouro route on 2026-08-02.
| Column | Range | Mean | Filled |
|---|---|---|---|
| case_type | 2 distinct | — | 100% |
| case_name | 2 distinct | — | 100% |
| input_file_id | 2 distinct | — | 100% |
| action_id | 2 distinct | — | 100% |
| route_id | 1 distinct | — | 100% |
| status | 2 distinct | — | 100% |
| formula | 1 distinct | — | 50% |
| n_atoms | 8–8 | 8 | 50% |
| prediction | 0.7584–0.7584 | 0.7584 | 50% |
| bag_std | 0.1676–0.1676 | 0.1676 | 50% |
| expected | 2 distinct | — | 100% |
| observation | 2 distinct | — | 100% |