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FindBRICSBonds #10

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Syzseisus opened this issue Sep 14, 2023 · 0 comments
Open

FindBRICSBonds #10

Syzseisus opened this issue Sep 14, 2023 · 0 comments

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@Syzseisus
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from RDKit ver. 2021.09, getting fragment by FindBRICSBonds is very limited.
For example, the mol having smiles CC(O)(P(=O)(O)O)P(=O)(O)O, unable to be decomposed.
How did you treat these exceptions?
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@Syzseisus