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Unsupervised EIC clusterization for HPTLC-HRMS

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OfficeChromatography/eicCluster

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Introduction

This repository contain a shiny app to remove background in HPTLC-HRMS data. Based on clusterisation of the extracted ion chromatograms, this method intends to separate the ions of interest from the background ions in high-performance thin-layer chromatography coupled with high resolution mass spectrometry data. The only function of the package launch a shiny app where the user can interactively analyse the data.

Installation

Install R https://www.r-project.org/

From cran

Incomming

From github

In the console, install the devtools package with those commands

install.packages("devtools")
library(devtools)
install_github("dimitrif/eicCluster")

Then, run this command to launch the application

eicCluster::run_eicCluster()

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