Popular repositories Loading

1. ms2_mass_differences ms2_mass_differences Public

   Identify meaningful mass differences in MS2 spectra to include in spectral embeddings/substructure models.

   Jupyter Notebook 2

2. improve_library_matching improve_library_matching Public

   Apply machine-learning to improve mass spectra based library matching

   Jupyter Notebook 1 3

3. ClassifyNPDB ClassifyNPDB Public

   Forked from OscarHoekstra/ClassifyNPDB

   All necessary script to run the pipeline I created during my Bsc Thesis

   Python

4. mibig_classifications mibig_classifications Public

   Retrieve chemical classes (ClassyFire/NPClassifier), as well as BGC classifications for MIBiG BGCs and match them.

   Jupyter Notebook 1

5. canopus_treemap canopus_treemap Public

   Forked from kaibioinfo/canopus_treemap

   CANOPUS visualization for Jupyter notebook

   Jupyter Notebook

6. nplinker nplinker Public

   Forked from NPLinker/nplinker

   Jupyter Notebook