LICENCE
MANIFEST.in
README.md
pyproject.toml
setup.cfg
MolNotator/Adnotator.py
MolNotator/Cosiner.py
MolNotator/Dereplicator.py
MolNotator/Duplicate_filter.py
MolNotator/Fragnotator.py
MolNotator/MGF_sample_slicer.py
MolNotator/MGF_updater.py
MolNotator/Mode_merger.py
MolNotator/MolNet.py
MolNotator/__init__.py
MolNotator.egg-info/PKG-INFO
MolNotator.egg-info/SOURCES.txt
MolNotator.egg-info/dependency_links.txt
MolNotator.egg-info/top_level.txt
examples/input_file.py
examples/working_directory/databases/211005_MIX_LDB.mgf
examples/working_directory/databases/211018_COLOTUS_DB.tsv
examples/working_directory/mzmine_out/200909_LDB_Thermo_NEG.csv
examples/working_directory/mzmine_out/200909_LDB_Thermo_NEG.mgf
examples/working_directory/mzmine_out/200912_LDB_Thermo_POS.csv
examples/working_directory/mzmine_out/200912_LDB_Thermo_POS.mgf
examples/working_directory/params/NEG_adduct_table_primary.tsv
examples/working_directory/params/NEG_adduct_table_secondary.tsv
examples/working_directory/params/POS_adduct_table_primary.tsv
examples/working_directory/params/POS_adduct_table_secondary.tsv
examples/working_directory/params/fragnotator_table.tsv
examples/working_directory/params/params.yaml
examples/working_directory/params/params_colotus.yaml
examples/working_directory/params/params_ldb_ions.yaml
images/icon_small.png