/spec2vec_gcms_data_analysis

Notebook for the analysis of spectra in GCMS samples

Primary LanguageJupyter Notebook

Spec2Vec GC/MS data analysis

Analysis of mass spectra in GC/MS samples using spec2vec and matchms repositories

To test first download Spec2vec and matchms repos

conda env create --file conda/environment-dev.yml
conda activate gcms-analysis
cd path_to_folder/spec2vec_gcms_data_analysis
jupyter notebook