public static UnlabelledTargetedResult CreateResult(MassTagResult result)
{
UnlabelledTargetedResult r = new UnlabelledTargetedResult();
r.ChargeState = result.MassTag == null ? 0 : result.MassTag.ChargeState;
r.DatasetName = result.Run.DatasetName;
r.IndexOfMostAbundantPeak = result.IsotopicProfile == null ? (short)0 : (short)result.IsotopicProfile.getIndexOfMostIntensePeak();
r.Intensity = result.IsotopicProfile == null ? 0f : (float)result.IsotopicProfile.IntensityAggregate;
r.IntensityI0 = result.IsotopicProfile == null ? 0f : (float)result.IsotopicProfile.GetMonoAbundance();
r.IntensityMostAbundantPeak = result.IsotopicProfile == null ? 0f : (float)result.IsotopicProfile.getMostIntensePeak().Height;
r.IScore = (float)result.InterferenceScore;
r.MassTagID = result.MassTag == null ? 0 : result.MassTag.ID;
r.MonoMass = result.IsotopicProfile.MonoIsotopicMass;
r.MonoMZ = result.IsotopicProfile.MonoPeakMZ;
r.NET = (float)result.GetNET();
r.NumChromPeaksWithinTol = result.NumChromPeaksWithinTolerance;
r.ScanLC = result.GetScanNum();
if (result.ChromPeakSelected != null)
{
double sigma = result.ChromPeakSelected.Width / 2.35;
r.ScanLCStart = (int)Math.Round(result.ChromPeakSelected.XValue - sigma);
r.ScanLCEnd = (int)Math.Round(result.ChromPeakSelected.XValue + sigma);
}
return(r);
}
private static void addAdditionalInfo(TargetedResultDTO tr, MassTagResult massTagResult)
{
// no other info needed now
}
