public void Add(PeakPoint pt)
{
int index = FindBucket(pt.GetMass());
if (!pointTable.ContainsKey(index))
{
pointTable[index] = new List <PeakPoint>();
}
pointTable[index].Add(pt);
points.Add(pt);
}
protected IDataPoints InitSpectrum(ISpectrum spectrum)
{
BucketSpectrumDataPoints data = new BucketSpectrumDataPoints(
(parameter as DPSpectrumCIDParameter).GetBucketSize(),
(parameter as DPSpectrumCIDParameter).GetMinRange());
int charge = (spectrum as ISpectrumMSn).GetParentCharge();
for (int i = 1; i <= charge; i++)
{
foreach (IPeak peak in spectrum.GetPeaks())
{
PeakPoint pt = new PeakPoint(peak.GetIntensity(), peak.GetMZ(), i, peak.GetMZ().ToString());
data.Add(pt);
}
}
return(data);
}
