public override string ToString()
{
if (IsotopicProfile == null)
{
return(base.ToString());
}
var data = new List <string>
{
MSFeatureID.ToString(),
ScanSet.PrimaryScanNumber.ToString(),
IsotopicProfile.MonoIsotopicMass.ToString("0.00000"),
IsotopicProfile.ChargeState.ToString(),
IsotopicProfile.MonoPeakMZ.ToString("0.00000"),
IntensityAggregate.ToString("0.00"),
IsotopicProfile.Score.ToString("0.0000"),
InterferenceScore.ToString("0.0000")
};
// Fit Score
// Uncomment to write out the fit_count_basis
//
//data.Add(this.IsotopicProfile.ScoreCountBasis); // Number of points used for the fit score
return(string.Join("; ", data));
}
public string Display()
{
return(Peak.XValue.ToString("0.00") + "\t" + Peak.NETValue.ToString("0.0000") + "\t" + Abundance + "\t" + FitScore.ToString("0.0000") + "\t" + InterferenceScore.ToString("0.000") + "\t" + IsIsotopicProfileFlagged);
}
