private IDictionary <ResultKey, ResultFile> MakeResults() { var dict = new Dictionary <ResultKey, ResultFile>(); var document = SrmDocument; if (document.Settings.HasResults) { for (int iResult = 0; iResult < document.Settings.MeasuredResults.Chromatograms.Count; iResult++) { var replicate = new Replicate(DataSchema, iResult); var chromatogramSet = document.Settings.MeasuredResults.Chromatograms[iResult]; for (int iFile = 0; iFile < chromatogramSet.MSDataFileInfos.Count; iFile++) { var resultFile = new ResultFile(replicate, chromatogramSet.MSDataFileInfos[iFile].FileId, 0); dict.Add(new ResultKey(replicate, iFile), resultFile); } } } return(dict); }
public TransitionResult(Transition transition, ResultFile resultFile) : base(transition, resultFile) { _chromInfo = CachedValue.Create(DataSchema, () => GetResultFile().FindChromInfo(transition.DocNode.Results)); _chromatogram = CachedValue.Create(DataSchema, () => new Chromatogram(new ChromatogramGroup(PrecursorResult), Transition)); }
public PeptideResult(Peptide peptide, ResultFile file) : base(peptide, file) { _chromInfo = CachedValue.Create(DataSchema, () => ResultFile.FindChromInfo(peptide.DocNode.Results)); _quantificationResult = CachedValue.Create(DataSchema, GetQuantification); _calibrationCurveFitter = CachedValue.Create(DataSchema, GetCalibrationCurveFitter); }
public PrecursorResult(Precursor precursor, ResultFile file) : base(precursor, file) { _chromInfo = CachedValue.Create(DataSchema, () => GetResultFile().FindChromInfo(precursor.DocNode.Results)); }
protected IDictionary <ResultKey, TResult> MakeChromInfoResultsMap <TChromInfo, TResult>( Results <TChromInfo> results, Func <ResultFile, TResult> newResultFunc) where TChromInfo : ChromInfo { if (results == null) { return(ImmutableSortedList <ResultKey, TResult> .EMPTY.AsDictionary()); } var replicates = DataSchema.ReplicateList; var resultFiles = DataSchema.ResultFileList; if (replicates.Count == results.Count && results.All(r => r.Count == 1 && r[0] != null)) { // If every replicate has exactly one result, then we can reuse the keys in "DataSchema.ReplicateList". var newValues = new List <TResult>(replicates.Count); for (int replicateIndex = 0; replicateIndex < replicates.Count; replicateIndex++) { var chromInfo = results[replicateIndex][0]; var optStep = ResultFile.GetOptStep(chromInfo); ResultFile resultFile = null; if (optStep == 0) { resultFiles.TryGetValue(new ResultFileKey(replicateIndex, chromInfo.FileId, optStep), out resultFile); } if (resultFile == null) { resultFile = new ResultFile(replicates.Values[replicateIndex], chromInfo.FileId, optStep); } newValues.Add(newResultFunc(resultFile)); } return(replicates.ReplaceValues(newValues).AsDictionary()); } var newEntries = new List <KeyValuePair <ResultKey, TResult> >(); for (int replicateIndex = 0; replicateIndex < results.Count; replicateIndex++) { var replicate = new Replicate(DataSchema, replicateIndex); var files = results[replicateIndex]; for (int fileIndex = 0; fileIndex < files.Count; fileIndex++) { var chromInfo = files[fileIndex]; if (null == chromInfo) { continue; } var key = fileIndex == 0 ? replicates.Keys[replicateIndex] : new ResultKey(replicate, fileIndex); int optStep = ResultFile.GetOptStep(chromInfo); ResultFile resultFile = null; if (optStep == 0) { resultFiles.TryGetValue(new ResultFileKey(replicateIndex, chromInfo.FileId, optStep), out resultFile); } if (resultFile == null) { resultFile = new ResultFile(replicates.Values[replicateIndex], chromInfo.FileId, optStep); } newEntries.Add(new KeyValuePair <ResultKey, TResult>(key, newResultFunc(resultFile))); } } return(ImmutableSortedList <ResultKey, TResult> .FromValues(newEntries, Comparer <ResultKey> .Default) .AsDictionary()); }
protected Result(SkylineDocNode docNode, ResultFile resultFile) : base(docNode.DataSchema) { SkylineDocNode = docNode; _resultFile = resultFile; }
public ProteinResult(Protein protein, ResultFile resultFile) : base(protein, resultFile) { }
protected static bool MatchesWithoutOptStep(ResultFile resultFile1, ResultFile resultFile2) { return(Equals(resultFile1.Replicate.ReplicateIndex, resultFile2.Replicate.ReplicateIndex) && ReferenceEquals(resultFile1.ChromFileInfoId, resultFile2.ChromFileInfoId)); }
protected static IEnumerable <TResult> FindResults(IDictionary <ResultKey, TResult> results, ResultFile resultFile) { return(results.Values.Where(result => MatchesWithoutOptStep(result.GetResultFile(), resultFile))); }
public TransitionResult(Transition transition, ResultFile resultFile) : base(transition, resultFile) { _chromInfo = CachedValue.Create(DataSchema, () => GetResultFile().FindChromInfo(transition.DocNode.Results)); }