You signed in with another tab or window. Reload to refresh your session.You signed out in another tab or window. Reload to refresh your session.You switched accounts on another tab or window. Reload to refresh your session.Dismiss alert
Querying coating compounds from the the MODENA dataset does not return SMILES (or InChIs). The dataEntry for "Citrate" (URI: "https://data.enanomapper.net/query/compound/url/all?media=application/json&search=https%3A%2F%2Fdata.enanomapper.net%2Fcompound%2F1306%2F%26media%3Dapplication%2Fjson") is e.g.
[{"compound"=>{"URI"=>"https://data.enanomapper.net/compound/1306/conformer/1425", "structype"=>"NA", "metric"=>nil, "name"=>"", "cas"=>"", "einecs"=>""}, "values"=>{"https://data.enanomapper.net/feature/http%3A%2F%2Fwww.opentox.org%2Fapi%2F1.1%23CASRNDefault"=>"6132-04-3", "https://data.enanomapper.net/feature/http%3A%2F%2Fwww.opentox.org%2Fapi%2F1.1%23ChemicalNameDefault"=>"Citrate"}, "facets"=>[], "bundles"=>{}}]
I can retrieve SMILES for MODENA core compounds and for core and coating compounds of other bundles (e.g. Protein Corona) with the same method.
The text was updated successfully, but these errors were encountered:
Querying coating compounds from the the MODENA dataset does not return SMILES (or InChIs). The dataEntry for "Citrate" (URI: "https://data.enanomapper.net/query/compound/url/all?media=application/json&search=https%3A%2F%2Fdata.enanomapper.net%2Fcompound%2F1306%2F%26media%3Dapplication%2Fjson") is e.g.
[{"compound"=>{"URI"=>"https://data.enanomapper.net/compound/1306/conformer/1425", "structype"=>"NA", "metric"=>nil, "name"=>"", "cas"=>"", "einecs"=>""}, "values"=>{"https://data.enanomapper.net/feature/http%3A%2F%2Fwww.opentox.org%2Fapi%2F1.1%23CASRNDefault"=>"6132-04-3", "https://data.enanomapper.net/feature/http%3A%2F%2Fwww.opentox.org%2Fapi%2F1.1%23ChemicalNameDefault"=>"Citrate"}, "facets"=>[], "bundles"=>{}}]
I can retrieve SMILES for MODENA core compounds and for core and coating compounds of other bundles (e.g. Protein Corona) with the same method.
The text was updated successfully, but these errors were encountered: