boecker-lab/docs.sirius.github.io

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boecker-lab/docs.sirius.github.io

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sirius

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)

sirius-libs

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

passatuto

source code of passatuto by Kerstin Scheubert

sirius-client-openAPI

openAPI (swagger-condegen) based libraries for different programming languages like R, Python and Ruby

standardizeUtils

A Python package for standardizing SMILES and InChI strings with RDKit and PubChem

Rsirius

myopic-mces-data

sirius-openchrom

OpenChrom plugin to perform SIRIUS LC-MS/MS small molecule analysis.

bcd-supertrees

The bcd supertrees algorithm implemented in java as a command line tool.

gecko

The official repository of the gecko gene cluster software