qualityMetrics: Get a vector of quality metrics than can be applied to...

In tnaake/msQC: MsQuality - Quality metric calculation from Spectra and MsExperiment objects

Get a vector of quality metrics than can be applied to object

Description

The function qualityMetrics returns a character vector with available quality metrics depending on object.

Usage

qualityMetrics(object)

Arguments

object

object of type Spectra or MsExperiment

Details

object is a Spectra or MsExperiment.

Value

character

Author(s)

Thomas Naake

Examples

library(Spectra)
spd <- DataFrame(
    msLevel = c(2L, 2L, 2L),
    polarity = c(1L, 1L, 1L),
    id = c("HMDB0000001", "HMDB0000001", "HMDB0001847"),
    name = c("1-Methylhistidine", "1-Methylhistidine", "Caffeine"))
## Assign m/z and intensity values
spd$mz <- list(
    c(109.2, 124.2, 124.5, 170.16, 170.52),
    c(83.1, 96.12, 97.14, 109.14, 124.08, 125.1, 170.16),
    c(56.0494, 69.0447, 83.0603, 109.0395, 110.0712,
        111.0551, 123.0429, 138.0662, 195.0876))
spd$intensity <- list(
    c(3.407, 47.494, 3.094, 100.0, 13.240),
    c(6.685, 4.381, 3.022, 16.708, 100.0, 4.565, 40.643),
    c(0.459, 2.585, 2.446, 0.508, 8.968, 0.524, 0.974, 100.0, 40.994))
spd$dataOrigin <- rep("sample_1", 3)
sps <- Spectra(spd)

qualityMetrics(object = sps)

tnaake/msQC documentation built on Jan. 30, 2025, 5:25 a.m.