avogadrio icon indicating copy to clipboard operation
avogadrio copied to clipboard

backup when using Vescalagin

Open AlcedoAttis opened this issue 8 years ago • 1 comments

github1

by inputting Vescalagin, (a complex molecule,) a backup is caused somewhere. I'd guess that a string "Backup" is returned and falsely interpreted.

AlcedoAttis avatar Sep 01 '17 09:09 AlcedoAttis

Hi there, thank you for bringing this to my attention. The "backup" image is passed back when something goes wrong while querying the Sourire API. In fact the exact line that results in the backup molecule is right here. Here's the SMILES string that actually breaks it:

O[C@H]1[C@H]2OC(=O)c3c1c(O)c(O)c(O)c3c4c(O)c(O)c(O)c5c4C(=O)OC2[C@@H]6OC(=O)c7cc(O)c(O)c(O)c7c8c(O)c(O)c(O)cc8C(=O)OCC6OC(=O)c9cc(O)c(O)c(O)c59

Further investigation required.

lambdacasserole avatar Nov 12 '17 19:11 lambdacasserole