Gas Chromatography-Mass Spectrometer(GC-MS) Data Analysis for Environmental Science. This package covered topics such as raw data process, molecular isotope ratio, matrix effects, etc. in environmental analysis.
|Author||Miao YU [aut, cre]|
|Date of publication||2016-11-30 14:55:19|
|Maintainer||Miao YU <firstname.lastname@example.org>|
batch: Get the MIR and related information from the files
combinemd: Combine two or more matrix
comparems: substrict two GC-MS data
findline: find line of the regression model
GetIntegration: GetIntegration was mainly used for get the intergration of...
Getisotopologues: Get the selected isotopologues at certain MS data
getmd: import data and return the annotated matrix for GC-MS
getsubmd: Subset the data mass spectrum of certain retention time and...
Integration: Just intergrate data according to fixed rt and fixed noise...
ma: filter data by average moving box
plotgroup: Plot the response group of GC-MS
plothist: plot the density of the GC-MS data with EM algorithm to...
plotint: plot the information of intergretion
plotintslope: plot the information of intergretion
plotkms: plot the kendrick mass defect diagram
plotms: plot GC-MS data as a heatmap
plotmsrt: Plot EIC of certain m/z and return dataframe for intergration
plotrtms: Plot mass spectrum of certain retention time and return mass...
plotsms: Plot the intensity distribution of GC-MS
plotsub: Plot the backgrond of data
plott: plot GC-MS data as a heatmap for constant speed of...
plottic: Plot Total Ion Chromatogram (TIC)
qbatch: Get the MIR from the file
writeMSP: Write MSP files for NIST search