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Updated SHRY. Fixed the bug reported in the discussion #12 #13

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merged 4 commits into from
Oct 1, 2023

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@kousuke-nakano kousuke-nakano commented Sep 25, 2023

I have fixed the bug reported in the discussion #12.

  • Added atol to the np.isclose calls in core.py. The default value was atol=1e-8 -> atol=const.DEFAULT_ATOL or atol = self._atol.
  • Introduced max_denominator=int(1 / const.DEFAULT_ATOL) argument to to_int_dict and inted_composition methods in the core.py module.
  • SHRY prints comments about the choice of atol (i.e., precision) if one comes across an error related to this.
  • Change the default --atol value in the script.py. default=const.DEFAULT_SYMPREC -> default=const.DEFAULT_ATOL. Is it a bug?
  • Updated test_core.py triggered by pytest such that it uses the default values for SYMPREC, ANGLE_TOLERANCE, and ATOL.
  • A GitHub action (shry-pytest.yml) is triggered also by a pull-request.
  • Added a new meta-programing line for the Composition.formula property to use our tolerance (atol).

@kousuke-nakano kousuke-nakano added bug Something isn't working enhancement New feature or request labels Sep 25, 2023
@kousuke-nakano kousuke-nakano self-assigned this Sep 25, 2023
@kousuke-nakano kousuke-nakano marked this pull request as ready for review September 25, 2023 06:38
@kousuke-nakano kousuke-nakano marked this pull request as draft September 25, 2023 13:24
@kousuke-nakano kousuke-nakano marked this pull request as ready for review September 26, 2023 04:50
@giprayogo giprayogo merged commit 510cf85 into giprayogo:devel Oct 1, 2023
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