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[CI] switch from Travis CI to GitHub actions #151

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@orbeckst orbeckst commented Oct 10, 2021

Fixes #146

Changes made in this Pull Request:

  • removed travis.yml and ci/deploy_docs.sh (not needed anymore)
  • add GH actions test and doc deployment
  • test MDAnalysis >= 1.1.1, <2 (noted in CHANGELOG)

PR Checklist

  • n/a Tests?
  • n/a Docs?
  • CHANGELOG updated?
  • Issue raised/referenced?

- fix #146
- test MDAnalysis >= 1.0.0, <2 (noted in CHANGELOG)
@orbeckst
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Various issues

@orbeckst orbeckst requested a review from VOD555 October 21, 2021 21:34
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We don't provide conda packages for Python 2.7 for 1.1.1. So we can either try to install the pip package for the 2.7 tests or drop 2.7 very quickly... I think it's going to be the latter.

@orbeckst orbeckst requested a review from yuxuanzhuang October 21, 2021 21:45
@orbeckst orbeckst force-pushed the travis2github branch 2 times, most recently from 30bbe88 to ca9a14d Compare October 28, 2021 22:23
- drop 2.7 (see #152)
- add 3.6
- note: 3.9 not supported in MDAnalysis 1.1.1
- update CHANGELOG
@orbeckst
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@VOD555 can you please figure out why one RDF test is failing

pmda/test/test_rdf_s.py::test_density[False] FAILED                      [ 22%]

This needs to be fixed/figured out so that this PR can progress. Thank you!

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ping @VOD555 please have a look

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VOD555 commented Nov 11, 2021

@orbeckst I found the density option of InterRDF_s in current MDAnalysis and pmda are different, in which density=False in MDA means density=True in pmda. It's necessary to make pmda the same as MDA. Do we need to do this change in this PR or in a new one?

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VOD555 commented Nov 11, 2021

It's corresponding to #130

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Make a new PR, please — let me know when you have it ready to review. Thanks!

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MAINT: Switch from Travis to Github actions as CI provider
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