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Note: T019 not available under Windows #313

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dominiquesydow opened this issue Dec 31, 2022 · 0 comments

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dominiquesydow commented Dec 31, 2022

T019 uses openmmforcefields, which depends on openff-toolkit, which depends on ambertools, which is not available under Windows.

Hence, we

do not add openmmforcefields as dependency to test_env.yml, though we do leave a comment,
install openmmforcefields under Linux and MacOS in the notebook (mamba install within the notebook)
do not test T019 under Windows in our CI (see ci.yml) but we do test it for Linux and MacOS

This issue was created to be referenced in our test_env.yml and ci.yml files.

(Previous discussions about this matter in: #136)

The text was updated successfully, but these errors were encountered:

dominiquesydow changed the title ~~T019 not available under Windows~~ Note: T019 not available under Windows

dominiquesydow mentioned this issue

CI: Exclude T019 again from Windows CI #362

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