lingyuzeng
8071a141ee
Keep key validation outputs and analysis tables tracked directly, package analysis plot PNGs into a small tar.gz backup, and add analysis scripts plus tests so the stored results remain reproducible without flooding git with large image trees.
237 B
237 B
| 1 | rows | unique_parent_molecules | unique_fragment_smiles | min_atom_count | p05_atom_count | p25_atom_count | median_atom_count | mean_atom_count | p75_atom_count | p95_atom_count | max_atom_count |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 2 | 34829 | 4451 | 1852 | 1 | 1.0 | 1.0 | 1.0 | 3.3206523299549224 | 2.0 | 14.0 | 48 |