Table 1.
Unique substructures in each library, and percent coverage of CSD library.
| Total | Organic | Metal-Organic | |
|---|---|---|---|
|
| |||
| CSD | 697813 (100%) | 182075 (100%) | 515738 (100%) |
| Free | 446121 (9%) | 122909 (22%) | 323212 (4%) |
| Open Babel | 2236 | 2236 | 0 |
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