Issue 1030: Small molecule improvements are predicted RT

issues
Status:resolved
Assigned To:Brian Pratt
Type:Defect
Area:Skyline
Priority:3
Milestone:4.3
Opened:2024-07-11 15:26 by Brian Pratt
Changed:2024-07-29 13:21 by Brian Pratt
Resolved:2024-07-29 13:21 by Brian Pratt
Resolution:Fixed
Closed:
2024-07-11 15:26 Brian Pratt
Title»Small molecule improvements are predicted RT
Assigned To»Brian Pratt
Type»Defect
Area»Skyline
Priority»3
Two things popped up in a recent Skyline course small molecule session:

A document that had explicit RT values for everything, but no iRT, would not Import Results when "Use only scans within ___ minutes of predicted RT" is selected. The lack of iRT shouldn't matter if everything has explicit RT

Brendan worked around this by creating a dummy iRT, while doing that he noticed that SSRCalc should not be on offer as an RT calculator in "Edit Retention Time Predictor" for small molecule mode.

2024-07-29 13:21 Brian Pratt
resolve as Fixed
Statusopen»resolved
Fixed by Brendan in commit 64a2fa127ea663f64adaeec6f1b3923eab505a58 7/14/2024