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API for tanimoto similarity #107

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aiswaryapawar opened this issue Jan 10, 2023 · 1 comment

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aiswaryapawar commented Jan 10, 2023

Hello,

I see that there is an API option for substructure search, but there isn't an option for tanimoto similarity.
This is for the substructure search:
https://coconut.naturalproducts.net/api/search/substructure?type=default&max-hits=100&smiles=O=C1OC(C(O)=C1O)CO

May I know, what is the API for the tanimoto search.

Thanks
A

Kohulan self-assigned this

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Kohulan commented Jan 11, 2023

Hi @aiswaryapawar ,
You could try the following,
https://coconut.naturalproducts.net/api/search/similarity?simThreshold=90type=default&max-hits=100&smiles=O=C1OC(C(O)=C1O)CO

Hope this helps.

Kohulan added the question label

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