add auto-deploy GHA workflow

[orbeckst]

• new GHA workflow deploy.yaml using MDAnalysis/pypi-deployment action
• add Trusted Publisher Management for PyPi and TestPyPi (externally done)

Additional fixes

• make RTD work again by mamba-installing dependencies
• update sphinx conf.py

[codecov]

Codecov Report

All modified and coverable lines are covered by tests ✅

Project coverage is 98.30%. Comparing base (ca280be) to head (6f49396).
Report is 8 commits behind head on main.

Additional details and impacted files

@@           Coverage Diff           @@
##             main      #74   +/-   ##
=======================================
  Coverage   98.30%   98.30%           
=======================================
  Files           2        2           
  Lines          59       59           
=======================================
  Hits           58       58           
  Misses          1        1           

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[orbeckst]

RTD fails with

Running Sphinx v5.3.0

Traceback (most recent call last):
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/registry.py", line 459, in load_extension
    mod = import_module(extname)
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/importlib/__init__.py", line 88, in import_module
    return _bootstrap._gcd_import(name[level:], package, level)
           ~~~~~~~~~~~~~~~~~~~~~~^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
  File "<frozen importlib._bootstrap>", line 1387, in _gcd_import
  File "<frozen importlib._bootstrap>", line 1360, in _find_and_load
  File "<frozen importlib._bootstrap>", line 1331, in _find_and_load_unlocked
  File "<frozen importlib._bootstrap>", line 935, in _load_unlocked
  File "<frozen importlib._bootstrap_external>", line 1022, in exec_module
  File "<frozen importlib._bootstrap>", line 488, in _call_with_frames_removed
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/builders/epub3.py", line 12, in <module>
    from sphinx.builders import _epub_base
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/builders/_epub_base.py", line 16, in <module>
    from sphinx.builders.html import BuildInfo, StandaloneHTMLBuilder
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/builders/html/__init__.py", line 46, in <module>
    from sphinx.writers.html import HTMLTranslator, HTMLWriter
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/writers/html.py", line 21, in <module>
    from sphinx.util.images import get_image_size
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/util/images.py", line 4, in <module>
    import imghdr
ModuleNotFoundError: No module named 'imghdr'

The above exception was the direct cause of the following exception:

Traceback (most recent call last):
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/cmd/build.py", line 276, in build_main
    app = Sphinx(args.sourcedir, args.confdir, args.outputdir,
                 args.doctreedir, args.builder, args.confoverrides, args.status,
                 args.warning, args.freshenv, args.warningiserror,
                 args.tags, args.verbosity, args.jobs, args.keep_going,
                 args.pdb)
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/application.py", line 219, in __init__
    self.setup_extension(extension)
    ~~~~~~~~~~~~~~~~~~~~^^^^^^^^^^^
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/application.py", line 398, in setup_extension
    self.registry.load_extension(self, extname)
    ~~~~~~~~~~~~~~~~~~~~~~~~~~~~^^^^^^^^^^^^^^^
  File "/home/docs/checkouts/readthedocs.org/user_builds/propkatraj/conda/74/lib/python3.13/site-packages/sphinx/registry.py", line 462, in load_extension
    raise ExtensionError(__('Could not import extension %s') % extname,
                         err) from err
sphinx.errors.ExtensionError: Could not import extension sphinx.builders.epub3 (exception: No module named 'imghdr')

Extension error:
Could not import extension sphinx.builders.epub3 (exception: No module named 'imghdr')

[orbeckst]

I am going to yolo this PR ... if anything needs changing please leave a comment and I'll address it post-hoc.