something wrong when candidate structure incorporating a"nitrone" group

Goodman-lab / DP5

Python workflow for DP5 and DP4 analysis of organic molecules

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something wrong when candidate structure incorporating a"nitrone" group #63

Open KPNK opened 2 years ago

KPNK commented 2 years ago

Dear Authors, if I input a structure with a nitrone group, then the workflow can not proceed and the above codes appear. Could you plz advise me how to solve this problem? Thank you!