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nmrML2BATMAN

Version: 1.0

Short Description

This tool converts Bruker raw files into tabulated txt file for BATMAN.

Description

Key features

  • Format Converter

Functionality

  • Format Converter for BATMAN

Approaches

  • Metabolomics

Instrument Data Types

  • NMR / 1D NMR

Tool Authors

  • Originally developed by Tim Ebbels and Jie Hao (Imperial College London)
  • Maintained by Jianliang and Vagelis (Imperial College London)

Container Contributors

  • Jianliang and Vagelis

Git Repository

Installation

in the folder where Dockerfile is hosted and run docker build -t <your_docker_image_name>:latest .

Usage Instructions

Copy Bruker raw data files into <path/to/data/folder>

Change work dir to <path/to/data/folder> and run

docker run -v $PWD:/data -ti <your_docker_image_name> -i /data/

Galaxy usage

A rudimentary Galaxy node description is included as bruker2batman.xml.

container-bruker2batman's People

Contributors

jianlianggao avatar

Watchers

James Cloos avatar  avatar

Forkers

phnmnl

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