Indigo
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Aromatize, Calculate SIP, Check Structure, Calculated Values do not work with structures with 'Any', 'Single/Double', 'Single/Aromatic', 'Double/Aromatic' bonds
Steps to reproduce:
- Create any structure
- Add any of 'Any', 'Single/Double', 'Single/Aromatic', 'Double/Aromatic' bond
- try /aromatize, /dearomatize, /calculate_cip, /calculate
Actual result: These functions don't work as structs received from them are not valid
Expected result: The functions work
Example of request request.zip
Clarified with @Alena-Guznischeva: we need to use the same error window for all server functions (for both: standalone and remote mode). @AlexanderSavelyev please clarify the priority of the issue.
The expected result for the ticket is not correct. It is not possible to do all operations for a structure with query features. The expected should be to return appropriate error message e.g. dearomatize can't be done for a query molecule. Also, we might want to create a feature request in future, if the canvas has several structures and some of them do not contain any query information, then calculate CIP and aromatize/dearomatize should work (not calculate properties) but it should be discussed additionally.
aromatize and check works CIP and calculate does not work