diffpy.labpdfproc 0.1.2rc0__tar.gz → 0.1.3__tar.gz

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (44) hide show
  1. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/CHANGELOG.rst +13 -0
  2. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/PKG-INFO +12 -5
  3. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/README.rst +11 -4
  4. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy.labpdfproc.egg-info/PKG-INFO +12 -5
  5. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy.labpdfproc.egg-info/SOURCES.txt +0 -1
  6. diffpy_labpdfproc-0.1.2rc0/doc/examples/zro2_mo.xy +0 -5630
  7. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/.codecov.yml +0 -0
  8. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/.coveragerc +0 -0
  9. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/.flake8 +0 -0
  10. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/.isort.cfg +0 -0
  11. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/.pre-commit-config.yaml +0 -0
  12. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/AUTHORS.rst +0 -0
  13. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/CODE_OF_CONDUCT.rst +0 -0
  14. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/LICENSE.rst +0 -0
  15. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/MANIFEST.in +0 -0
  16. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/environment.yml +0 -0
  17. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/pyproject.toml +0 -0
  18. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/requirements/README.txt +0 -0
  19. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/requirements/build.txt +0 -0
  20. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/requirements/conda.txt +0 -0
  21. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/requirements/docs.txt +0 -0
  22. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/requirements/pip.txt +0 -0
  23. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/requirements/requirements-dev.txt +0 -0
  24. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/requirements/test.txt +0 -0
  25. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/setup.cfg +0 -0
  26. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/__init__.py +0 -0
  27. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/labpdfproc/__init__.py +0 -0
  28. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/labpdfproc/data/coefficient_list.csv +0 -0
  29. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/labpdfproc/data/inverse_cve.xy +0 -0
  30. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/labpdfproc/functions.py +0 -0
  31. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/labpdfproc/labpdfprocapp.py +0 -0
  32. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/labpdfproc/mud_calculator.py +0 -0
  33. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/labpdfproc/tools.py +0 -0
  34. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy/labpdfproc/version.py +0 -0
  35. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy.labpdfproc.egg-info/dependency_links.txt +0 -0
  36. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy.labpdfproc.egg-info/entry_points.txt +0 -0
  37. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy.labpdfproc.egg-info/requires.txt +0 -0
  38. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/src/diffpy.labpdfproc.egg-info/top_level.txt +0 -0
  39. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/tests/conftest.py +0 -0
  40. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/tests/test_fixtures.py +0 -0
  41. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/tests/test_functions.py +0 -0
  42. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/tests/test_mud_calculator.py +0 -0
  43. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/tests/test_tools.py +0 -0
  44. {diffpy_labpdfproc-0.1.2rc0 → diffpy_labpdfproc-0.1.3}/tests/test_version.py +0 -0
@@ -4,6 +4,19 @@ Release Notes
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  .. current developments
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+ 0.1.2
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+ =====
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+
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+ **Added:**
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+
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+ * polynomial interpolation as the default method for cve computation.
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+
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+ **Fixed:**
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+
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+ * add PyPI packages under pip.txt
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+
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+
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+
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  0.1.1
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  =====
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@@ -1,6 +1,6 @@
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  Metadata-Version: 2.1
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  Name: diffpy.labpdfproc
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- Version: 0.1.2rc0
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+ Version: 0.1.3
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  Summary: Tools for processing x-ray powder diffraction data from laboratory sources.
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  Author-email: "Simon J.L. Billinge group" <simon.billinge@gmail.com>
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  Maintainer-email: "Simon J.L. Billinge group" <simon.billinge@gmail.com>
@@ -115,14 +115,16 @@ To add "conda-forge" to the conda channels, run the following in a terminal. ::
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  We want to install our packages in a suitable conda environment.
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  The following creates and activates a new environment named ``diffpy.labpdfproc_env`` ::
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- conda create -n diffpy.labpdfproc_env python=3
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+ conda create -n diffpy.labpdfproc_env diffpy.labpdfproc
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  conda activate diffpy.labpdfproc_env
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- Then, to fully install ``diffpy.labpdfproc`` in our active environment, run ::
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+ To confirm that the installation was successful, type ::
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- conda install diffpy.labpdfproc
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+ python -c "import diffpy.labpdfproc; print(diffpy.labpdfproc.__version__)"
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- Another option is to use ``pip`` to download and install the latest release from
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+ The output should print the latest version displayed on the badges above.
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+
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+ If the above does not work, you can use ``pip`` to download and install the latest release from
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  `Python Package Index <https://pypi.python.org>`_.
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  To install using ``pip`` into your ``diffpy.labpdfproc_env`` environment, type ::
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@@ -155,6 +157,11 @@ Please type ::
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  for more information on the available options.
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+ Getting Started
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+ ---------------
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+
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+ You may consult our `online documentation <https://diffpy.github.io/diffpy.labpdfproc>`_ for tutorials and API references.
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+
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  Support and Contribute
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  ----------------------
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@@ -83,14 +83,16 @@ To add "conda-forge" to the conda channels, run the following in a terminal. ::
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  We want to install our packages in a suitable conda environment.
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  The following creates and activates a new environment named ``diffpy.labpdfproc_env`` ::
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- conda create -n diffpy.labpdfproc_env python=3
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+ conda create -n diffpy.labpdfproc_env diffpy.labpdfproc
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  conda activate diffpy.labpdfproc_env
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- Then, to fully install ``diffpy.labpdfproc`` in our active environment, run ::
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+ To confirm that the installation was successful, type ::
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- conda install diffpy.labpdfproc
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+ python -c "import diffpy.labpdfproc; print(diffpy.labpdfproc.__version__)"
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- Another option is to use ``pip`` to download and install the latest release from
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+ The output should print the latest version displayed on the badges above.
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+
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+ If the above does not work, you can use ``pip`` to download and install the latest release from
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  `Python Package Index <https://pypi.python.org>`_.
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  To install using ``pip`` into your ``diffpy.labpdfproc_env`` environment, type ::
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@@ -123,6 +125,11 @@ Please type ::
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  for more information on the available options.
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+ Getting Started
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+ ---------------
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+
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+ You may consult our `online documentation <https://diffpy.github.io/diffpy.labpdfproc>`_ for tutorials and API references.
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+
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  Support and Contribute
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  ----------------------
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  Metadata-Version: 2.1
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  Name: diffpy.labpdfproc
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- Version: 0.1.2rc0
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+ Version: 0.1.3
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  Summary: Tools for processing x-ray powder diffraction data from laboratory sources.
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  Author-email: "Simon J.L. Billinge group" <simon.billinge@gmail.com>
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  Maintainer-email: "Simon J.L. Billinge group" <simon.billinge@gmail.com>
@@ -115,14 +115,16 @@ To add "conda-forge" to the conda channels, run the following in a terminal. ::
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  We want to install our packages in a suitable conda environment.
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  The following creates and activates a new environment named ``diffpy.labpdfproc_env`` ::
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- conda create -n diffpy.labpdfproc_env python=3
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+ conda create -n diffpy.labpdfproc_env diffpy.labpdfproc
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  conda activate diffpy.labpdfproc_env
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- Then, to fully install ``diffpy.labpdfproc`` in our active environment, run ::
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+ To confirm that the installation was successful, type ::
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- conda install diffpy.labpdfproc
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+ python -c "import diffpy.labpdfproc; print(diffpy.labpdfproc.__version__)"
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- Another option is to use ``pip`` to download and install the latest release from
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+ The output should print the latest version displayed on the badges above.
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+
127
+ If the above does not work, you can use ``pip`` to download and install the latest release from
126
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  `Python Package Index <https://pypi.python.org>`_.
127
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  To install using ``pip`` into your ``diffpy.labpdfproc_env`` environment, type ::
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@@ -155,6 +157,11 @@ Please type ::
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  for more information on the available options.
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+ Getting Started
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+ ---------------
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+
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+ You may consult our `online documentation <https://diffpy.github.io/diffpy.labpdfproc>`_ for tutorials and API references.
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+
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  Support and Contribute
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  ----------------------
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@@ -11,7 +11,6 @@ MANIFEST.in
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  README.rst
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  environment.yml
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  pyproject.toml
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- doc/examples/zro2_mo.xy
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  requirements/README.txt
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  requirements/build.txt
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  requirements/conda.txt