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Temporarily remove GAFF because of parmchk2 issues #329

Merged
merged 13 commits into from
May 3, 2024
Merged

Temporarily remove GAFF because of parmchk2 issues #329

merged 13 commits into from
May 3, 2024

Commits on May 2, 2024

  1. Temporarily remove GAFF because of parmchk2 issues

    @mattwthompson
    mattwthompson committed May 2, 2024
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  2. Drop OpenEye from tests

    @mattwthompson
    mattwthompson committed May 2, 2024
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  3. Drop automerge action

    @mattwthompson
    mattwthompson committed May 2, 2024
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  4. Update Python and AmberTools versions, run tests in parallel

    @mattwthompson
    mattwthompson committed May 2, 2024
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  5. Remove Espaloma from test environment

    @mattwthompson
    mattwthompson committed May 2, 2024
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  6. Remove Espaloma CI

    @mattwthompson
    mattwthompson committed May 2, 2024
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  7. Refactor some tests to enable skipping GAFF

    @mattwthompson
    mattwthompson committed May 2, 2024
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Commits on May 3, 2024

  1. Skip SPC/E test when iterating over small molecule force fields

    @mattwthompson
    mattwthompson committed May 3, 2024
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  2. Update default force field in SystemGenerator

    @mattwthompson
    mattwthompson committed May 3, 2024
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  3. Streamline testing

    @mattwthompson
    mattwthompson committed May 3, 2024
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  4. Update testing setup

    @mattwthompson
    mattwthompson committed May 3, 2024
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  5. Mask CodeCov upload failures

    @mattwthompson
    mattwthompson committed May 3, 2024
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  6. Add release notes

    @mattwthompson
    mattwthompson committed May 3, 2024
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