API for xia-lab/OptiLCMS
Optimized LC-MS Spectra Processing

Global functions
.CentroidSpectra Source code
.aggregateMethod2int Source code
.applyRtAdjToChromPeaks Source code
.applyRtAdjustment Source code
.createProfileMatrix Source code
.emptyscan.remove Source code
.exportmSetRuleClass Source code
.feature_values Source code
.get.current.plan Source code
.get.rdt.set Source code
.getChromPeakData Source code
.getDataPath Source code
.getDdaMS2Scans Source code
.getPeakGroupsRtMatrix Source code
.get_closest_index Source code
.groupval Source code
.insertColumn Source code
.match_trim_vector_index Source code
.match_trim_vectors Source code
.narrow_rt_boundaries Source code
.on.public.web Source code
.peakIndex Source code
.perform.fast.univ.tests Source code
.rawMat Source code
.replace.by.lod Source code
.set.rdt.set Source code
.testReadMSDataInput Source code
CachePathCorrection Source code
CentroidCheck Man page Source code
CentroidMSData Man page Source code
ColMax Source code
CommandOrganize Source code
CommandsVerify Source code
ComputeEncasing Source code
ContaminatsRemoval Source code
DecoSpectra Source code
Densitygrouping_slave Source code
DescendMin Source code
DescendZero Source code
DescendZeroR Source code
DetectMS2Design Source code
ExecutePlan Man page Source code
ExperimentsCluster_doe Source code
Export.Annotation Man page Source code
Export.PeakSummary Man page Source code
Export.PeakTable Man page Source code
FastRunningShow_auto Source code
FastRunningShow_customized Source code
FilesInclusion_identifier Source code
FindEqualGreaterM Source code
FormatMSnAnnotation Man page Source code
FormatPeakList Man page Source code
GaussModel Man page
GeneratePeakList Source code
GetDist3D Source code
GetRGBColorGradient Source code
ImportRawMSData Man page Source code
InitDataObjects Man page Source code
InitializaPlan Man page Source code
MSW.extendLength Source code
MSW.extendNBase Source code
MSW.getLocalMaximumCWT Source code
MSW.getRidge Source code
MessageOutput Source code
MirrorPlotting Source code
OptiChromPeaks Source code
OptiLCMS Man page
ParamsChanged Source code
Path2Files Source code
PeakGroupCV Source code
PeakPicking_Massifquant_slave Source code
PeakPicking_MatchedFilter_slave Source code
PeakPicking_centWave_slave Source code
PeakPicking_core Source code
PeakPicking_prep Source code
PerformAsariResultsFormating Source code
PerformBlankSubstraction Source code
PerformDBSearchingBatch Man page Source code
PerformDDADeco Source code
PerformDDADeconvolution Man page Source code
PerformDIADeco Source code
PerformDIADeconvolution Man page Source code
PerformDIA_main Source code
PerformDataInspect Man page Source code
PerformDataTrimming Man page Source code
PerformFastUnivTests Source code
PerformFormulaGeneration Source code
PerformMSDataOutput Source code
PerformMSnImport Man page Source code
PerformMassMatching Source code
PerformMirrorPlotting Man page Source code
PerformParamsOptimization Man page Source code
PerformPeakAlignment Man page Source code
PerformPeakAnnotation Man page Source code
PerformPeakFiling Man page Source code
PerformPeakGrouping Source code
PerformPeakPicking Man page Source code
PerformPeakProfiling Man page Source code
PerformROIExtraction Man page Source code
PerformRTcorrection Source code
PerformResultsExport Man page Source code
PerformSpectrumConsenus Man page Source code
PlotSpectraBPIadj Man page Source code
PlotSpectraInsensityStistics Man page Source code
PlotSpectraPCA Man page Source code
PlotSpectraRTadj Man page Source code
PlotXIC Man page Source code
RT.Adjust_peakGroup Source code
R_set_obiwarpR Source code
RectUnique Source code
SSgaussStats Source code
SanitySpectra Source code
SetAnnotationParam Man page Source code
SetGlobalParallel Man page Source code
SetPeakParam Man page Source code
SetPlotParam Man page Source code
SlaveCluster_doe Source code
SpectraClean Source code
SpectraDeconvCore Source code
SpectraSearching Source code
SpectraSearchingBatch Source code
SpectraSearchingSingle Source code
SpectrumConsensus Source code
Statistic_doe Source code
UpdateRawfiles Man page Source code
WhichColMax Source code
addFragments Source code
adjustRtimeSubset Source code
adjustRtime_obiwarp Source code
adjustRtime_peakGroup Source code
annotateGrp Source code
annotation_export Source code
attachList Source code
binYonXR Source code
breaks_on_nBinsR Source code
cache.read Source code
cache.save Source code
calcCV Source code
calcCiS Source code
calcGaussianS Source code
calcIsotopeMatrix Source code
calcMaximumCarbon Source code
calcPC.hcs Source code
calcPPS2 Source code
calcRCS_GSValues Source code
calculatePPKs Source code
calculateSet_doe Source code
calculate_entropy_similarity Man page Source code
calculate_unweighted_entropy_similarity Man page Source code
cent Source code
checkHypothese Source code
checkIntensitiesAtRtBoundaries Source code
checkIps Source code
checkIsotopes Source code
checkNormalDistribution Source code
checkOidCausality Source code
checkParams Source code
checkQuasimolion Source code
checkSinusDistribution Source code
checkfac Source code
combineCalc Source code
combineParams Source code
continuousPtsAboveThreshold Source code
continuousPtsAboveThresholdIdx Source code
continuousPtsAboveThresholdIdxR Source code
continuousPtsAboveThresholdR Source code
controller.modifier Source code
controller.resetter Source code
creatPeakTable Source code
create.matrix Source code
createHypothese Source code
createModel Source code
decode Source code
decodeAll Source code
descendMinR Source code
descendMinTol Source code
dia_feature_preparation Source code
encode Source code
envir.save Source code
estimatePPM Source code
estimateSNThresh Source code
expand.grid.subset Source code
extFUN Source code
extractPeakForGaussian Source code
fast.write.csv Source code
fastMatchR Source code
featureSUM Source code
filterPeaksfromNoise Source code
filterPpmError Source code
filtfft Source code
findAdducts Source code
findEqualGreaterMR Source code
findIsotopes.CAMERA Source code
findIsotopes.IPO Source code
findIsotopesPspec Source code
findTruePeaks Source code
find_matches Source code
findmzROIR Source code
fitGauss Source code
formatFileSpectrumNames Source code
gauss Source code
gaussCoverage Source code
generateMS2dbOpt_optilcms Source code
generatePvals_SigFeatures Source code
getAllPeakEICs Source code
getCcdParameter Source code
getClusterType Source code
getEIC4Peaks Source code
getEICR Source code
getIntensitiesFromRawdata Source code
getLocalNoiseEstimate Source code
getMZR Source code
getMaxSettings Source code
getMaximumLevels Source code
getPeaklist Source code
getPeaks_selection Source code
getRGTVValues Source code
get_reference_sample_id Source code
getderivativeIons Source code
groupval Source code
imputeLinInterpol Source code
info.save Source code
is.wholenumber Source code
isCdfFile Source code
jobFinished Source code
joinOverlappingPeaks Source code
mSet Man page
mSet.obiwarp Source code
mSet2xcmsSet Source code
marker_record Source code
massDiffMatrix Source code
massifquantROIs Source code
mpi.comm.size Source code
my.col2rgba Source code
my.json.scatter Source code
mz.trim_random Source code
mz.trim_specific Source code
na.flatfill Source code
naOmit Source code
normalize_spectrum Source code
optimize.xcms.doe Source code
optimizxcms.doe.peakpicking Source code
parse_ms2peaks Source code
peakTableSUM Source code
peaks_IPO Source code
peakwidth_est Source code
perform.command Source code
perform.plan Source code
plot.MS_3D Source code
plotBPIs Man page Source code
plotMSfeature Man page Source code
plotSingleTIC Man page Source code
plotTICs Man page Source code
ppmEstCore Source code
ppm_diff Source code
process_project Source code
profMat Source code
profiling_param_identifier Source code
read.InMemMSd.data Source code
read.MSdata Source code
read.OnDiskMS.data Source code
readLists Source code
recordMarker_resetter Source code
recording_identifier Source code
rectUniqueR Source code
resolveFragmentConnections Source code
resultIncreased_doe Source code
rgba_to_hex_opacity Source code
rowcolFt Source code
rowcoltt Source code
rt.trim_random Source code
rt.trim_specific Source code
run_process Source code
running.plan Man page Source code
sampclass Source code
scale_range Source code
setCacheEnv Source code
setDefaultLists Source code
ssm_trim Source code
testCacheArg Source code
testNormalDistribution Source code
testSinusDistribution Source code
trimm Source code
typeCastParams Source code
updateRawSpectraPath Man page Source code
valueCount2ScanIndex Source code Source code
xia-lab/OptiLCMS documentation built on Nov. 6, 2024, 11:01 a.m.