.gitignore
CITATION.cff
CODE_OF_CONDUCT.md
CONTRIBUTING.md
LICENSE
README.dev.md
README.md
mkdocs.yml
pyproject.toml
sonar-project.properties
.githooks/pre-commit
.github/ISSUE_TEMPLATE/config.yml
.github/ISSUE_TEMPLATE/missing-quantity.yml
.github/workflows/build.yml
.github/workflows/cffconvert.yml
.github/workflows/documentation-deploy.yml
.github/workflows/documentation-test.yml
.github/workflows/markdown-link-check.yml
.github/workflows/publish.yml
.github/workflows/sonarcloud.yml
docs/index.md
docs/_templates/.gitignore
docs/application/data_pipeline_template.md
docs/assets/custom.css
docs/assets/fontawesome.min.js
docs/assets/icon.png
docs/assets/logo.png
docs/assets/mathjax.js
docs/assets/solid.min.js
docs/development/development.md
docs/introduction/introduction.md
docs/methods/concentrations.md
docs/methods/data.md
docs/methods/na_screening.md
docs/methods/ordination.md
docs/methods/overview.md
docs/methods/stable_isotopes.md
docs/reference/reference_analysis.md
docs/reference/reference_data.md
docs/reference/reference_visualize.md
examples/ex01_Griftpark/example_01_grift_NAscreening.ipynb
examples/ex01_Griftpark/example_01_grift_NAscreening.py
examples/ex01_Griftpark/example_01_grift_data.ipynb
examples/ex01_Griftpark/example_01_grift_isotope.ipynb
examples/ex01_Griftpark/example_01_grift_isotope.py
examples/ex01_Griftpark/example_01_grift_isotopes_benzene.png
examples/ex01_Griftpark/grift_BTEXIIN.csv
examples/ex01_Griftpark/grift_BTEXIIN_isotopes.csv
examples/ex02_Amersfoort/amersfoort.xlsx
examples/ex02_Amersfoort/example_02_amersfoort.py
examples/ex02_Amersfoort/example_02_amersfoort_isotopes_lambda.py
examples/ex02_Amersfoort/example_02_amersfoort_ordination.ipynb
examples/ex02_Amersfoort/example_02_amersfoort_ordination.py
examples/ex02_Amersfoort/example_02_amersfoort_ordination_constrained.py
mibiscreen/__init__.py
mibiscreen.egg-info/PKG-INFO
mibiscreen.egg-info/SOURCES.txt
mibiscreen.egg-info/dependency_links.txt
mibiscreen.egg-info/requires.txt
mibiscreen.egg-info/top_level.txt
mibiscreen/analysis/__init__.py
mibiscreen/analysis/reduction/__init__.py
mibiscreen/analysis/reduction/ordination.py
mibiscreen/analysis/reduction/stable_isotope_regression.py
mibiscreen/analysis/reduction/transformation.py
mibiscreen/analysis/sample/__init__.py
mibiscreen/analysis/sample/concentrations.py
mibiscreen/analysis/sample/properties.py
mibiscreen/analysis/sample/screening_NA.py
mibiscreen/data/__init__.py
mibiscreen/data/check_data.py
mibiscreen/data/load_data.py
mibiscreen/data/set_data.py
mibiscreen/data/example_data/__init__.py
mibiscreen/data/example_data/example_data.csv
mibiscreen/data/example_data/example_data.py
mibiscreen/data/example_data/example_data.xlsx
mibiscreen/data/settings/__init__.py
mibiscreen/data/settings/contaminants.py
mibiscreen/data/settings/environment.py
mibiscreen/data/settings/isotopes.py
mibiscreen/data/settings/metabolites.py
mibiscreen/data/settings/sample_settings.py
mibiscreen/data/settings/standard_names.py
mibiscreen/data/settings/unit_settings.py
mibiscreen/visualize/__init__.py
mibiscreen/visualize/activity.py
mibiscreen/visualize/ordination_plot.py
mibiscreen/visualize/stable_isotope_plots.py
mockups/data_analysis_mockup.ipynb
mockups/modeling_mockup.ipynb
tests/__init__.py
tests/test_activity.py
tests/test_concentrations.py
tests/test_data.py
tests/test_na_screening.py
tests/test_ordination.py
tests/test_ordination_plot.py
tests/test_stable_isotope_plot.py
tests/test_stable_isotope_regression.py
tests/test_transformation.py