acquisitionTime-peakPantheRAnnotation-method | acquisitionTime accessor returns value as.POSIXct |
annotationDiagnosticMultiplot | Generate a multiplot of all diagnostic plots |
annotation_diagnostic_multiplot_UI_helper | UI diagnostic plot helper - single feature multiplot |
annotationDiagnosticPlots-peakPantheRAnnotation-method | Generate fit diagnostic plots |
annotation_fit_summary_UI_helper | UI diagnostic table - fit summary |
annotationParamsDiagnostic-peakPantheRAnnotation-method | Set uROI and FIR based on annotation results |
annotation_showMethod_UI_helper | UI show annotation helper - list of properties |
annotation_showText_UI_helper | UI show annotation helper - UI sidebar string |
annotationTable-peakPantheRAnnotation-method | annotationTable accessor |
cpdID-peakPantheRAnnotation-method | cpdID accessor |
cpdMetadata-peakPantheRAnnotation-method | cpdMetadata accessor |
cpdName-peakPantheRAnnotation-method | cpdName accessor |
dataPoints-peakPantheRAnnotation-method | dataPoints accessor |
EICs-peakPantheRAnnotation-method | EICs accessor |
emgGaussian_guess | Guess function for initial exponentially modified gaussian... |
emgGaussian_minpack.lm | Implementation of the Exponentially Modified Gaussian (EMG)... |
emgGaussian_minpack.lm_objectiveFun | Exponentially Modified Gaussian minpack.lm objective function |
extractSignalRawData | Extract signal in a multiple defined mz rt window from a raw... |
filename-peakPantheRAnnotation-method | filename accessor by spliting filepath |
filepath-peakPantheRAnnotation-method | filepath accessor |
findTargetFeatures | Find and integrate target features in each ROI |
FIR-peakPantheRAnnotation-method | FIR accessor returns targetFeatTable with cpdID, cpdName... |
fitCurve | Curve fitting using minpack.lm |
gaussian_cerf | Gaussian Error function |
gaussian_erf | Gaussian Error function |
generateIonChromatogram | Generate ion chromatogram from raw data points |
getAcquisitionDatemzML | Parse acquisition date from a mzML file |
getTargetFeatureStatistic | Calculate chromatographic peak properties |
initialise_annotation_from_files_UI_helper | UI data import helper - initialise new annotation from files |
integrateFIR | Integrate fallback integration regions |
isAnnotated-peakPantheRAnnotation-method | isAnnotated accessor |
is.peakPantheR_curveFit | Check if object is of class peakPantheR_curveFit |
load_annotation_from_file_UI_helper | UI data import helper - check loaded annotation |
nbCompounds-peakPantheRAnnotation-method | nbCompounds accessor established on cpdID |
nbSamples-peakPantheRAnnotation-method | nbSamples accessor established on filepath |
outputAnnotationDiagnostic-peakPantheRAnnotation-method | Save to disk the annotation parameters as CSV and a... |
outputAnnotationFeatureMetadata_UI_helper | UI export helper - feature metadata |
outputAnnotationParamsCSV-peakPantheRAnnotation-method | Save annotation parameters as CSV |
outputAnnotationResult-peakPantheRAnnotation-method | Save to disk all annotation results as csv files |
outputAnnotationSpectraMetadata_UI_helper | UI export helper - spectra path and metadata |
peakFit-peakPantheRAnnotation-method | peakFit accessor |
peakPantheR | peakPantheR: A package for Peak Picking and ANnoTation of... |
peakPantheRAnnotation | An S4 class to represent peakPantheR annotation results |
peakPantheR_applyRTCorrection | Correct targeted retention time based on reference compounds |
peakPantheR_loadAnnotationParamsCSV | Load fit parameters from CSV |
peakPantheR_parallelAnnotation | Search, integrate and report targeted features in a multiple... |
peakPantheR_plotEICFit | Plot samples raw data and detected feature for a single ROI |
peakPantheR_plotPeakwidth | Plot peak value and peakwidth by acquisition time or in input... |
peakPantheR_ROIStatistics | Save to disk each ROI EIC and mean IS RT |
peakPantheR_singleFileSearch | Search, integrate and report targeted features in a raw... |
peakPantheR_start_GUI | peakPantheR Graphical User Interface |
peakTables-peakPantheRAnnotation-method | peakTables accessor with cpdID and cpdName added back |
plotEICDetectedPeakwidth | Plot samples raw data and detected feature for a single ROI |
plotHistogram | Plot variable histogram and density |
predictCurve | Predict curve values |
prepare_advanced_target_parameters | Process target region parameters (with uROI, FIR) for object... |
prepare_basic_target_parameters | Process target region parameters (simple format) for object... |
resetAnnotation-peakPantheRAnnotation-method | Reset a peakPantheRAnnotation and alter samples and compounds... |
resetFIR-peakPantheRAnnotation-method | Reset FIR windows to uROI or ROI values Reset FIR windows to... |
retentionTimeCorrection-peakPantheRAnnotation-method | Apply retention time correction methods to adjust the... |
ROI-peakPantheRAnnotation-method | ROI accessor returns targetFeatTable with cpdID, cpdName... |
saveSingleFileMultiEIC | Save to disk a plot of all ROI EIC and detected feature range |
skewedGaussian_guess | Guess function for initial skewed gaussian parameters and... |
skewedGaussian_minpack.lm | Implementation of the Skewed Gaussian peak shape for use with... |
skewedGaussian_minpack.lm_objectiveFun | Skewed Gaussian minpack.lm objective function |
spectra_metadata_colourScheme_UI_helper | UI export plot helper - sample colour |
spectraMetadata-peakPantheRAnnotation-method | spectraMetadata accessor |
spectraPaths_and_metadata_UI_helper | UI data import helper - prepare file paths and metadata |
sub-peakPantheRAnnotation-ANY-ANY-ANY-method | extract parts of peakPantheRAnnotation class |
TIC-peakPantheRAnnotation-method | TIC accessor |
uROIExist-peakPantheRAnnotation-method | uROIExist accessor |
uROI-peakPantheRAnnotation-method | uROI accessor returns targetFeatTable with cpdID, cpdName... |
useFIR-peakPantheRAnnotation-method | useFIR accessor |
useUROI-peakPantheRAnnotation-method | useUROI accessor |
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