public static List <DbIrtPeptide> GetUnscoredIrtPeptides(List <DbIrtPeptide> dbIrtPeptides, RCalcIrt calcIrt)
{
var dbIrtPeptidesFilter = new List <DbIrtPeptide>();
// Filter out peptides that have the same sequence and iRT as those in the database
foreach (var dbIrtPeptide in dbIrtPeptides)
{
double?oldScore = calcIrt != null?calcIrt.ScoreSequence(dbIrtPeptide.PeptideModSeq) : null;
if (oldScore == null || Math.Abs(oldScore.Value - dbIrtPeptide.Irt) > DbIrtPeptide.IRT_MIN_DIFF)
{
dbIrtPeptidesFilter.Add(dbIrtPeptide);
}
}
return(dbIrtPeptidesFilter);
}
