Open phraenquex opened 8 months ago
Ticket #1277 left a loose end: @kaliif grouped LHS observations by dataset (when he got no response to a a problem he found.)
But this is the wrong grouping; it must be (canonical site, compound).
(Groupings can and will accumulate observations from multiple datasets, over time.)
I couldn't work out what problem @kaliif was describing in that comment above, but a lot changed in XCA since then, so maybe it was an artefact.
Maybe needs screen-to-screen discussion? Or re-testing with a very up-to-date XCA output. (@Waztom please help.)
Moving back to in-progress. But do say if it needs a separate ticket.
Original spec was here: https://github.com/m2ms/fragalysis-frontend/issues/1277#issuecomment-1921289765
This IS the expected behaviour, but not yet tested - we'll raise a ticket when it shows up as bug.
Ticket #1277 left a loose end: @kaliif grouped LHS observations by dataset (when he got no response to a a problem he found.)
But this is the wrong grouping; it must be (canonical site, compound).
(Groupings can and will accumulate observations from multiple datasets, over time.)
I couldn't work out what problem @kaliif was describing in that comment above, but a lot changed in XCA since then, so maybe it was an artefact.
Maybe needs screen-to-screen discussion? Or re-testing with a very up-to-date XCA output. (@Waztom please help.)
Moving back to in-progress. But do say if it needs a separate ticket.