public void getDriftProfileFromRawDataMZ_967_Test1() { Run run = TestUtilities.GetStandardUIMFRun(); UIMFRun uimfRun = (UIMFRun)run; DriftTimeProfileExtractor profileExtractor = new DriftTimeProfileExtractor(); FrameSet frameset = new FrameSet(804, 803, 805); uimfRun.CurrentFrameSet = frameset; double targetMZ = 967.26; ScanSetCollectionCreator ssc = new ScanSetCollectionCreator(run, 200, 350, 9, 1); ssc.Create(); //XYData xydata = profileExtractor.ExtractProfileFromRawData(uimfRun, frameset, run.ScanSetCollection, targetMZ, 30d); createPeaks(run); XYData xydata = profileExtractor.ExtractProfileFromPeakData(uimfRun, frameset, run.ScanSetCollection, targetMZ, 30d); TestUtilities.DisplayXYValues(xydata); }
public void getDriftProfileMZ_796_Test1() //** { Run run = TestUtilities.GetStandardUIMFRun(); UIMFRun uimfRun = (UIMFRun)run; DriftTimeProfileExtractor profileExtractor = new DriftTimeProfileExtractor(); FrameSet frameset = new FrameSet(616, 615, 617); uimfRun.CurrentFrameSet = frameset; double targetMZ = 1004.1987; ScanSetCollectionCreator ssc = new ScanSetCollectionCreator(run, 200, 350, 1, 1); ssc.Create(); XYData xydata = profileExtractor.ExtractProfileFromRawData(uimfRun, frameset, run.ScanSetCollection, targetMZ, 30d); TestUtilities.DisplayXYValues(xydata); Console.WriteLine("-------------------------------------------------------------------------------------"); createPeaks(run); xydata = profileExtractor.ExtractProfileFromPeakData(uimfRun, frameset, run.ScanSetCollection, targetMZ, 30d); TestUtilities.DisplayXYValues(xydata); }
public void getDriftProfileFromRawDataMZ_771_Test1() { Run run = TestUtilities.GetStandardUIMFRun(); UIMFRun uimfRun = (UIMFRun)run; DriftTimeProfileExtractor profileExtractor = new DriftTimeProfileExtractor(); FrameSet frameset = new FrameSet(805, 804, 806); double targetMZ1 = 746.3842; double targetMZ2 = 771.6894; ScanSetCollectionCreator ssc = new ScanSetCollectionCreator(run, 200, 350, 1, 1); ssc.Create(); System.Diagnostics.Stopwatch sw = new System.Diagnostics.Stopwatch(); sw.Start(); XYData xydata = profileExtractor.ExtractProfileFromRawData(uimfRun, frameset, run.ScanSetCollection, targetMZ2, 10d); sw.Stop(); TestUtilities.DisplayXYValues(xydata); Console.WriteLine(sw.ElapsedMilliseconds); }