CCS_Calu_SingleField: CCS_Calu_SingleField

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

Description

Calculate CCS values using single field method

Usage

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

Arguments

raw.data	Character. The excel file name. The top 3 columns should be named as: 'M', 'Adducts', 'Arrival.time'
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

a csv table includs, m/z and CCS values etc.

Author(s)

Zhiwei Zhou [e-mail]

Examples

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

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