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Summary of the fingerprint-based structural diversity of the entire compounds.
| Dataset | Morgan2 a (1024-bits) |
MACCS Keys a (166-bits) |
|---|---|---|
| COCONUT | 0.107 | 0.380 |
| FooDB | 0.092 | 0.322 |
| DCM | 0.136 | 0.407 |
| CAS | 0.117 | 0.473 |
| 3CLP inhibitors | 0.127 | 0.403 |
a Median similarity.
