dgpost 2.3.1__tar.gz → 2.4__tar.gz

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Files changed (65) hide show
  1. {dgpost-2.3.1/src/dgpost.egg-info → dgpost-2.4}/PKG-INFO +4 -3
  2. {dgpost-2.3.1 → dgpost-2.4}/pyproject.toml +4 -3
  3. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/impedance.py +1 -1
  4. dgpost-2.4/src/dgpost/transform/permittivity.py +689 -0
  5. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/reflection.py +41 -36
  6. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/extract.py +33 -8
  7. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/helpers.py +1 -0
  8. {dgpost-2.3.1 → dgpost-2.4/src/dgpost.egg-info}/PKG-INFO +4 -3
  9. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost.egg-info/SOURCES.txt +2 -0
  10. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost.egg-info/requires.txt +3 -2
  11. {dgpost-2.3.1 → dgpost-2.4}/tests/test_extract.py +37 -0
  12. dgpost-2.4/tests/test_permittivity.py +40 -0
  13. {dgpost-2.3.1 → dgpost-2.4}/tests/test_reflection.py +2 -0
  14. {dgpost-2.3.1 → dgpost-2.4}/LICENSE +0 -0
  15. {dgpost-2.3.1 → dgpost-2.4}/README.md +0 -0
  16. {dgpost-2.3.1 → dgpost-2.4}/setup.cfg +0 -0
  17. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/__init__.py +0 -0
  18. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/main.py +0 -0
  19. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/__init__.py +0 -0
  20. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/catalysis.py +0 -0
  21. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/chromatography.py +0 -0
  22. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/circuit_utils/__init__.py +0 -0
  23. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/circuit_utils/circuit_components.py +0 -0
  24. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/circuit_utils/circuit_parser.py +0 -0
  25. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/complex.py +0 -0
  26. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/electrochemistry.py +0 -0
  27. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/mixtures.py +0 -0
  28. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/rates.py +0 -0
  29. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/transform/table.py +0 -0
  30. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/__init__.py +0 -0
  31. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/load.py +0 -0
  32. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/parse.py +0 -0
  33. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/pivot.py +0 -0
  34. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/plot.py +0 -0
  35. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/save.py +0 -0
  36. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost/utils/transform.py +0 -0
  37. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost.egg-info/dependency_links.txt +0 -0
  38. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost.egg-info/entry_points.txt +0 -0
  39. {dgpost-2.3.1 → dgpost-2.4}/src/dgpost.egg-info/top_level.txt +0 -0
  40. {dgpost-2.3.1 → dgpost-2.4}/tests/test_catalysis_atbal.py +0 -0
  41. {dgpost-2.3.1 → dgpost-2.4}/tests/test_catalysis_conversion.py +0 -0
  42. {dgpost-2.3.1 → dgpost-2.4}/tests/test_catalysis_selectivity.py +0 -0
  43. {dgpost-2.3.1 → dgpost-2.4}/tests/test_catalysis_yield.py +0 -0
  44. {dgpost-2.3.1 → dgpost-2.4}/tests/test_chromatography.py +0 -0
  45. {dgpost-2.3.1 → dgpost-2.4}/tests/test_complex.py +0 -0
  46. {dgpost-2.3.1 → dgpost-2.4}/tests/test_electrochemistry_charge.py +0 -0
  47. {dgpost-2.3.1 → dgpost-2.4}/tests/test_electrochemistry_current.py +0 -0
  48. {dgpost-2.3.1 → dgpost-2.4}/tests/test_electrochemistry_fe.py +0 -0
  49. {dgpost-2.3.1 → dgpost-2.4}/tests/test_electrochemistry_nernst.py +0 -0
  50. {dgpost-2.3.1 → dgpost-2.4}/tests/test_impedance.py +0 -0
  51. {dgpost-2.3.1 → dgpost-2.4}/tests/test_load.py +0 -0
  52. {dgpost-2.3.1 → dgpost-2.4}/tests/test_main.py +0 -0
  53. {dgpost-2.3.1 → dgpost-2.4}/tests/test_mixtures_flowtofraction.py +0 -0
  54. {dgpost-2.3.1 → dgpost-2.4}/tests/test_parse.py +0 -0
  55. {dgpost-2.3.1 → dgpost-2.4}/tests/test_pivot.py +0 -0
  56. {dgpost-2.3.1 → dgpost-2.4}/tests/test_plot.py +0 -0
  57. {dgpost-2.3.1 → dgpost-2.4}/tests/test_rates_batchtomolar.py +0 -0
  58. {dgpost-2.3.1 → dgpost-2.4}/tests/test_rates_flowtomolar.py +0 -0
  59. {dgpost-2.3.1 → dgpost-2.4}/tests/test_realworld.py +0 -0
  60. {dgpost-2.3.1 → dgpost-2.4}/tests/test_roundtrip.py +0 -0
  61. {dgpost-2.3.1 → dgpost-2.4}/tests/test_save.py +0 -0
  62. {dgpost-2.3.1 → dgpost-2.4}/tests/test_table_apply_linear.py +0 -0
  63. {dgpost-2.3.1 → dgpost-2.4}/tests/test_table_combine_columns.py +0 -0
  64. {dgpost-2.3.1 → dgpost-2.4}/tests/test_table_combine_namespaces.py +0 -0
  65. {dgpost-2.3.1 → dgpost-2.4}/tests/test_table_set_uncertainty.py +0 -0
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: dgpost
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- Version: 2.3.1
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+ Version: 2.4
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  Summary: datagram post-processing toolkit
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  Author: Ueli Sauter
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  Author-email: Peter Kraus <peter.kraus@tu-berlin.de>
@@ -19,7 +19,7 @@ Requires-Python: >=3.10
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  Description-Content-Type: text/markdown
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  License-File: LICENSE
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  Requires-Dist: numpy>=1.20
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- Requires-Dist: uncertainties<3.2
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+ Requires-Dist: uncertainties>=3.2.0
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  Requires-Dist: pandas<3.0
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  Requires-Dist: openpyxl
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  Requires-Dist: pint>=0.24.1
@@ -28,10 +28,11 @@ Requires-Dist: rdkit>=2022.3
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  Requires-Dist: h5netcdf>=1.0
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  Requires-Dist: xarray>=2024.10.0
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  Requires-Dist: dgbowl-schemas>=122
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- Requires-Dist: matplotlib>=3.5.0
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+ Requires-Dist: matplotlib<3.11,>=3.5.0
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  Provides-Extra: testing
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  Requires-Dist: pytest; extra == "testing"
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  Requires-Dist: ruff; extra == "testing"
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+ Requires-Dist: h5py; extra == "testing"
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  Provides-Extra: docs
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  Requires-Dist: sphinx~=7.2; extra == "docs"
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  Requires-Dist: sphinx-rtd-theme~=1.3.0; extra == "docs"
@@ -26,7 +26,7 @@ classifiers = [
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  requires-python = ">= 3.10"
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  dependencies = [
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  "numpy >= 1.20",
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- "uncertainties < 3.2",
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+ "uncertainties >= 3.2.0",
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  "pandas < 3.0",
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  "openpyxl",
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  "pint >= 0.24.1",
@@ -35,13 +35,14 @@ dependencies = [
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  "h5netcdf >= 1.0",
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  "xarray >= 2024.10.0",
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  "dgbowl-schemas >= 122",
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- "matplotlib >= 3.5.0",
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+ "matplotlib >= 3.5.0, < 3.11",
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  ]
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  [project.optional-dependencies]
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  testing = [
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  "pytest",
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  "ruff",
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+ "h5py",
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  ]
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  docs = [
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  "sphinx ~= 7.2",
@@ -66,4 +67,4 @@ dirty_template = "{tag}.dev{ccount}"
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  [tool.pytest.ini_options]
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  log_cli = false
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- log_cli_level = "DEBUG"
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+ log_cli_level = "DEBUG"
@@ -79,7 +79,7 @@ def fit_circuit(
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  | | +------------+---------------+--------------+
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  | | | ``CPE_a`` | (0, 1) | |
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  +------------------------+--------+------------+---------------+--------------+
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- | Warburg element | ``W`` | ``W`` | (0, 1e10) | Ω·s⁻¹ᐟ² |
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+ | Warburg element | ``W`` | ``W`` | (0, 1e10) | Ω·s⁻¹ᐟ² |
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  +------------------------+--------+------------+---------------+--------------+
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  | Warburg short element | ``Ws`` | ``Ws_R`` | (0, 1e10) | Ω |
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  | | +------------+---------------+--------------+