You signed in with another tab or window. Reload to refresh your session.You signed out in another tab or window. Reload to refresh your session.You switched accounts on another tab or window. Reload to refresh your session.Dismiss alert
RawSignalsSimulation is not including all of the chosen masses that were originally selected.
Consider a case where you have chosen 8 masses and 3 molecules.
If only 7 of those masses are present for those 3 molecules, then ExperimentData.mass_fragment_numbers will be trimmed down to only those 7. This makes sense for solving. However, it turns out that a consequence is that signal simulation now does not include the 8th mass as a simulated mass. I think things are different in iterative, so one option would be to just do an iterative analysis and single iteration if one wants all 8 simulated masses.
However, in that situation the feature implicitSLScorrection can't be used.
This is probably okay, but then the preprocessed data export should also export a version of the signals with only these downselected masses. Right now signal simulation data can't be compared directly to the pre-processed data as easily because of this.
The text was updated successfully, but these errors were encountered:
AdityaSavara
changed the title
Pre-processed data masses do not match ExperimentData.mass_fragment_numbers and RawSignalsSimulation
Pre-processed data masses should have a version with an abscissa that matches ExperimentData.mass_fragment_numbers and RawSignalsSimulation
May 9, 2021
RawSignalsSimulation is not including all of the chosen masses that were originally selected.
Consider a case where you have chosen 8 masses and 3 molecules.
If only 7 of those masses are present for those 3 molecules, then ExperimentData.mass_fragment_numbers will be trimmed down to only those 7. This makes sense for solving. However, it turns out that a consequence is that signal simulation now does not include the 8th mass as a simulated mass. I think things are different in iterative, so one option would be to just do an iterative analysis and single iteration if one wants all 8 simulated masses.
However, in that situation the feature implicitSLScorrection can't be used.
This is probably okay, but then the preprocessed data export should also export a version of the signals with only these downselected masses. Right now signal simulation data can't be compared directly to the pre-processed data as easily because of this.
The text was updated successfully, but these errors were encountered: