Table 1. Statistics of Chemical Subspace Generation.
subspace | acyclic, saturated backbones | all saturated backbones | closed-shell molecules | all fragmentsa | redundant structures |
---|---|---|---|---|---|
[CHO]1F | 2 | 2 | 2 | 9 | 0 |
[CHO]2F | 5 | 5 | 9 | 31 | 0 |
[CHO]3F | 10 | 13 | 28 | 131 | 23 |
[CHO]4F | 20 | 32 | 99 | 679 | 236 |
Redundant (e.g., resonance) structures are not included in this number.