Cal_SingleField: Cal_SingleField

In JustinZZW/ImmsTools: Some tools for ion mobility mass spectrometry data processing

Description

Establish calibration curve using single field method

Usage

Cal_SingleField(polarity="pos", charge=1, Agilent.table="V1")

Arguments

raw.data	the data.frame including following columns
polarity	Character. Ionzation polarity of experiments. Should be one of "pos" or "neg". "pos" denotes "positive mode", "neg" denotes "negative mode". Default is "pos".
charge	Numeric. The charge of calibrants. Default is 1.
Agilent.table	Character. The verison of Agilent tuning mix reference table is used to establish calibration Scurve. "V1" denotes the reference table in Agilent IM-MS browser B.07.01; "V2" denotes the reference table reported by Stow et. al. Anal. Chem. 2017

Value

"TFix" is the coefficient denoting the mobility-indenpend flight time, "Beta" is the coefficient denoting the instrument-dependent proportionality cofficient.

Author(s)

Zhiwei Zhou [e-mail]

Examples

Cal_SingleField(polarity="pos", charge=1, Agilent.table="V1", file.name = "Single_Field_cal_result")

JustinZZW/ImmsTools documentation built on July 9, 2019, 9:32 a.m.