private void buildProfiles() {
log.info("Filling repository with profiles");
List<String> referenceProfile;
List<String> referenceGeneNames;
Set<GctReplicate> gctReplicatePairs = repositoryService.getGctReplicatesCombinations();
int dummyClusteringOrder = gctReplicatePairs.size();
for (GctReplicate gctReplicate : gctReplicatePairs) {
GctFile gctFile = gctReplicate.getGctFile();
ReplicateAnnotation replicateAnnotation = gctReplicate.getReplicateAnnotation();
List<PeakArea> peakAreas =
peakAreaRepository.findByGctFileAndReplicateAnnotation(gctFile, replicateAnnotation);
AssayType assayType = gctFile.getAssayType();
referenceProfile = getReferenceProfile(assayType);
referenceGeneNames = getReferenceGeneNames(assayType);
Double[] profileVector = new Double[referenceProfile.size()];
boolean[] imputeVector = new boolean[referenceProfile.size()];
for (PeakArea peakArea : peakAreas) {
int index = referenceProfile.indexOf(peakArea.getPeptideAnnotation().getPeptideId());
profileVector[index] = peakArea.getValue();
}
UtilsStatistics.imputeProfileVector(profileVector, imputeVector);
Profile profile =
new Profile(
replicateAnnotation,
gctFile,
ArrayUtils.toPrimitive(profileVector),
imputeVector,
referenceProfile,
referenceGeneNames,
dummyClusteringOrder--);
profileRepository.save(profile);
}
}
private void loadDataPoints() throws IOException, CommandException {
log.info("Loading peak areas from panorama gct files");
List<String> gctDownloadUrls = connectPanorama.gctDownloadUrls(true);
for (String url : gctDownloadUrls) {
HashMap<String, List<ParseGCT.AnnotationValue>> metaPeptides = new HashMap<>();
HashMap<String, List<ParseGCT.AnnotationValue>> metaReplicas = new HashMap<>();
ArrayList<ParseGCT.PeptideReplicatePeak> peakValues = new ArrayList<>();
try {
parser.parseToRepository(url, peakValues, metaPeptides, metaReplicas);
} catch (Exception e) {
}
GctFile gctfile = new GctFile(url);
int runId = UtilsParse.parseRunId(url);
String runIdUrl = connectPanorama.getRunIdLink(gctfile);
gctfile.setRunId(runId);
gctfile.setRunIdUrl(runIdUrl);
gctFileRepository.save(gctfile);
List<String> probeNameIds = new ArrayList<>(metaPeptides.keySet());
AssayType assayType = UtilsParse.parseArrayTypeFromUrl(url);
HashMap<String, Integer> peptideIdsForChromatogramsUrl =
connectPanorama.getPeptideIdsFromJSON(probeNameIds, assayType, runId);
for (ParseGCT.PeptideReplicatePeak peakFromGct : peakValues) {
String peptideId = peakFromGct.getPeptideId();
String replicateId = peakFromGct.getReplicateId();
PeptideAnnotation peptideAnnotation =
peptideAnnotationRepository.findFirstByPeptideId(peptideId);
ReplicateAnnotation replicateAnnotation =
replicateAnnotationRepository.findFirstByReplicateId(replicateId);
if (peptideAnnotation == null) {
log.warn("Peptide annotation is null");
}
if (replicateAnnotation == null) {
log.warn("Replicate annotation is null");
}
Double peakAreaValue = peakFromGct.getPeakArea();
for (ParseGCT.AnnotationValue annotationObject : metaPeptides.get(peptideId)) {
String annotationName = annotationObject.getAnnotationName();
String annotationValue = annotationObject.getAnnotationValue();
if (annotationName.equals("pr_probe_suitability_manual")
&& annotationValue.equals("FALSE")) {
peakAreaValue = null;
}
}
String chromatogramUrl =
connectPanorama.getChromatogramUrl(
assayType, peptideIdsForChromatogramsUrl.get(peptideId), replicateId);
PeakArea peakArea =
new PeakArea(
gctfile, peptideAnnotation, replicateAnnotation, peakAreaValue, chromatogramUrl);
peakAreaRepository.save(peakArea);
}
}
}