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1. CFM-Pipeline CFM-Pipeline Public

   The CFM-Pipeline: This repo contains the CFM-Pipeline, this tool takes an input csv containing IDs and SMILES and turns these in to in silico mass spectra.

   Python 1

2. NpDb_expansion NpDb_expansion Public

   Contains all the scripts needed for the expansion of the NpDb

   Python 1

3. Bash-scripts Bash-scripts Public

   contains all the used bash scripts in this project

   Shell

4. Python_scripts Python_scripts Public

   contains all the used python scripts in this project

   Python

5. inchiKeyCreatorPipeline inchiKeyCreatorPipeline Public

   contains the scripts needed to get the inchiKeyPipeline up and running.

   Python 1

6. NpDbExtractor NpDbExtractor Public

   A GUI made to extract data from the natural product database

   Java