retentionTimeCalibration: Title Use internal standard retention to cailbrate retention...

Description Usage Arguments Value References Examples

View source: R/retentionTimeCalibration.R

Description

Title Use internal standard retention to cailbrate retention time of metabolites in database.

Usage

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retentionTimeCalibration(is.tR.file, database.df)

Arguments

is.tR.file,

the txt file of IS retention times in database and experimental.

database.df,

the imported database dataframe.

Value

calibrated.RT.db

References

Huan, T. et al. DnsID in MyCompoundID for rapid identification of dansylated amine- and phenol-containing metabolites in LC-MS-based metabolomics. Anal. Chem. 87, 9838-9845 (2015).

Examples

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load(system.file("extdata/testData", "dbDataTest.rda", package = "MetEx"))
calibrated.RT.db <- retentionTimeCalibration(is.tR.file =
                    system.file("extdata/trCalibration",
                    "IS-for-tR-calibration.xlsx", package = "MetEx"),
                    database.df = dbDataTest)

zhengfj1994/MeTEA documentation built on June 29, 2021, 5:21 a.m.