getpmd: Get pmd for specific reaction

In pmd: Paired Mass Distance Analysis for GC/LC-MS Based Non-Targeted Analysis and Reactomics Analysis

Description

Get pmd for specific reaction

Usage

getpmd(list, pmd, rtcutoff = 10, corcutoff = NULL, digits = 2, accuracy = 4)

Arguments

list	a list with mzrt profile
pmd	a specific paired mass distance
rtcutoff	cutoff of the distances in retention time hierarchical clustering analysis, default 10
corcutoff	cutoff of the correlation coefficient, default NULL
digits	mass or mass to charge ratio accuracy for pmd, default 2
accuracy	measured mass or mass to charge ratio in digits, default 4

Value

list with paired peaks for specific pmd.

See Also

getpaired,getstd,getsda,getrda

Examples

data(spmeinvivo)
pmd <- getpmd(spmeinvivo,pmd=15.99)

pmd documentation built on Jan. 22, 2021, 1:06 a.m.