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agpl-3.0

SIRIUS is a software for discovering a landscape of de-novo identification of metabolites using tandem mass spectrometry. This repository contains the code of the SIRIUS Software (GUI and CLI)

java denovo sirius ms-data science fingerid ms-spectra csi-fingerid mass-spectra metabolomics bioinformatics cheminformatics isotope-pattern mass-spectrometry molecular-formulas fragmentation-trees molecular-structures structure-elucidation

Created 2017-06-16

4,333 commits to stable branch, last one 28 days ago

sirius-libs sirius-ms

unknown

sirius-libs - Metabolomics mass spectrometry framework for molecular formula identification of small molecules written in Java

denovo ms-data ms-spectra java-library metabolomics bioinformatics cheminformatics mass-spectrometry molecular-formulas scientific-computing

Created 2017-03-16

3,933 commits to stable branch, last one 12 months ago