public virtual void AddSelectedChromPeakAndScanSet(ChromPeak bestPeak, ScanSet scanSet, Globals.IsotopicProfileType isotopicProfileType)
{
if (isotopicProfileType == Globals.IsotopicProfileType.UNLABELED)
{
ChromPeakSelected = bestPeak;
ScanSet = scanSet;
if (ScanSet != null)
{
NumMSScansSummed = ScanSet.IndexValues.Count;
}
var failedChromPeakSelection = (ChromPeakSelected == null || Math.Abs(ChromPeakSelected.XValue) < double.Epsilon);
if (failedChromPeakSelection)
{
FailedResult = true;
FailureType = Globals.TargetedResultFailureType.ChrompeakNotFoundWithinTolerances;
}
else
{
FailedResult = false;
FailureType = Globals.TargetedResultFailureType.None;
}
}
else
{
throw new NotSupportedException("Cannot add data for a labeled result in this base class");
}
}
public virtual void ResetResult()
{
Flags.Clear();
ErrorDescription = "";
Score = 1;
InterferenceScore = 1;
IsotopicProfile = null;
ChromPeakSelected = null;
FailedResult = false;
FailureType = Globals.TargetedResultFailureType.None;
}
