MassSpecMethod_CorrectMatrixSuppression_TiChri S7 class
Source:R/class_MassSpecMethod_CorrectMatrixSuppression.R
MassSpecMethod_CorrectMatrixSuppression_TiChri.Rd
Settings for correcting matrix suppression based on the TiChri algorithm from
Tisler et al. (2021). The algorithm
calculates the matrix profile for the total ion chromatogram (TIC) and corrects the matrix
suppression for features. Internal standards can be assigned to improve the correction. The
suppression_factor
is added to the feature list and can be used to correct the features
intensity. The argument/parameter correctIntensity
is available in plotting and processing
methods and when TRUE
, the suppression factor is used to correct the feature intensity for
better comparison across analyses with different matrix suppression.
Usage
MassSpecMethod_CorrectMatrixSuppression_TiChri(
mpRtWindow = 10,
istdAssignment = "none",
istdRtWindow = 5,
istdN = 2
)
Arguments
- mpRtWindow
Numeric of length one with the retention time window (in seconds) for calculating the matrix profile.
- istdAssignment
Character of length one with the assignment method for internal standards. Possible values are
"nearest"
,"range"
, and"none"
. Default is"nearest"
. Setting"nearest"
assigns the nearestistdN
internal standard/s,"range"
assigns internal standard/s within theistdRtWindow
window, and"none"
does not assign internal standards. If internal standards are assigned, thetichri
value is calculated for each internal standard and used to correct the matrix suppression for the features. If no internal standards are assigned, the correction is based only on the TIC matrix profile, which is less accurate.- istdRtWindow
Numeric of length one with the retention time window (in seconds) for assigning internal standards. Default is
5
.- istdN
Integer of length one with the number of internal standards to assign. Default is
2
.
References
Tisler S, Pattison DI, Christensen JH (2021). “Correction of Matrix Effects for Reliable Non-target Screening LC–ESI–MS Analysis of Wastewater.” Analytical Chemistry, 93(24), 8432-8441. doi:10.1021/acs.analchem.1c00357 , PMID: 34096716, https://doi.org/10.1021/acs.analchem.1c00357.