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Set PyMBAR solver to "robust" and use PyMBAR4 #871

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wants to merge 7 commits into from
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Set PyMBAR solver to "robust" and use PyMBAR4 #871

wants to merge 7 commits into from

Commits on Jun 17, 2024

  1. Set solver to robust

    @hannahbaumann
    hannahbaumann committed Jun 17, 2024
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  2. Use PyMBAR >= 4.0

    @hannahbaumann
    hannahbaumann committed Jun 17, 2024
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  3. Reset env name

    @hannahbaumann
    hannahbaumann committed Jun 17, 2024
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  4. Fix Pep8 issue

    @hannahbaumann
    hannahbaumann committed Jun 17, 2024
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  5. Pin perses to see if that resolves CI failure

    @hannahbaumann
    hannahbaumann committed Jun 17, 2024
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  6. Reverse perses env change

    @hannahbaumann
    hannahbaumann committed Jun 17, 2024
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Commits on Jul 4, 2024

  1. Merge branch 'main' into pymbar4_fix

    @IAlibay
    IAlibay authored Jul 4, 2024
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