pedb

In silico generated database for common PEs.

datasets

Lipid annotation in untargeted liquid chromatography-data independent acquisition-mass spectrometry lipidomics based on fragmentation and intensity rules. Alcoriza-Balaguer MI, Garcia-Canaveras JC, Lopez A, Conde I, Juan O, Carretero J, Lahoz A (2019) <doi:10.1021/acs.analchem.8b03409>.

M Alcoriza-Balaguer

LipidMS

Lipid Annotation for LC-MS/MS DIA Data

pedb function

Data frame with 147 observations and the following 3 variables.<dl class="dl-horizontal">
 <dt><code>formula</code></dt><dd>character vector containing molecular formulas.</dd>
 <dt><code>total</code></dt><dd>character vector indicating the total number of carbons
 and double bounds of the chains.</dd>
 <dt><code>Mass</code></dt><dd>numeric vector with the neutral masses.</dd>
 </dl>

Format

PEs database — pedb

Data frame with 147 observations and the following 3 variables.<dl class='dl-horizontal'>
 <dt><code>formula</code></dt><dd>character vector containing molecular formulas.</dd>
 <dt><code>total</code></dt><dd>character vector indicating the total number of carbons
 and double bounds of the chains.</dd>
 <dt><code>Mass</code></dt><dd>numeric vector with the neutral masses.</dd>
 </dl>

pedb: PEs database

Description

Usage

Arguments

Format