Blank2022intmat | Example intensity matrix from Blank 2022 |
Blank2022peaks | Example peaks from Blank 2022 |
Blank2022res | Example MALDIassay object from Blank 2022 |
Blank2022spec | Example spectra from Blank 2022 |
calculateChauvenetCriterion | Calculate Chauvenet's criterion for outlier detection |
calculateCurveFit | Calculate the fit for a dose-response curve |
calculateSSMD | Calculate strictly standardized mean difference (SSMD) |
calculateVPrime | Calculate V'-Factor |
calculateZPrime | Calculate Z'-factor of assay quality |
checkRecalibration | Check the recalibration of spectra from a MALDIassay object |
extractIntensity | Extract intensity using peaks as template |
extractSpots | Extract the spot coordinates |
filterVariance | Filter for high variance signals |
fitCurve | Fit dose-response curves |
getAllMz | Get all mz value of an MALDIassay-object |
getAppliedMzShift | Extract applied mz-shift |
getAppliedNormFactors | Extract applied normalization factors |
getAvgPeaks | Extract peaks of average spectra |
getAvgSpectra | Extract average spectra |
getBinTol | Get binning tolerance |
getConc | Extract the concentrations used in a MALDIassay |
getCurveFits | Extract curve fits |
getFittingParameters | Get fitting parameters |
getIntensityMatrix | Get the intensity matrix of single spectra for all fitted... |
getMzFromMzIdx | Get the mz value associated with a mzIdx |
getMzShift | Get mass shift for target mz |
getNormFactors | Get normalization factors from peak data.frame |
getNormMethod | Extract normalization method |
getNormMz | Extract m/z used for normalization |
getNormMzTol | Extract tolerance used for normalization |
getPeakStatistics | Extract peak statistics |
getRecalibrationError | Calculate remaining calibration error of a MALDIassay object |
getSinglePeaks | Extract peaks of single spectra spectra (before average... |
getSingleSpecIntensity | Extract the intensities of single spectra for a given mzIdx |
getSNR | Extract SNR used for peak detection |
getSpots | Get the spot coordinates of spectra |
getVarFilterMethod | Extract variance filtering method |
isMALDIassay | Check if object if of class MALDIassay |
loadSpectra | load bruker MALDI target plate spectra |
loadSpectraMzML | load mzML spectra |
MALDIassay-class | Class MALDIassay |
normalize | Normalize spectra and peaks |
normalizeByFactor | Apply normalization factors to spectra |
plotCurves | generate ggplot objects for each of the curve fits in a... |
plotPeak | Plot a peak of interest from a MALDIassay object |
shiftMassAxis | Shift mass axis |
transformConc2Log | Convert concentration to log10 and replace zero's |
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