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Perses mapper #930

Merged
merged 8 commits into from
Sep 16, 2024
Merged

Perses mapper #930

merged 8 commits into from
Sep 16, 2024

Commits on Sep 3, 2024

  1. add abstract methods for PersesAtomMApper, activate tests

    @jthorton
    jthorton committed Sep 3, 2024
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Commits on Sep 4, 2024

  1. lint

    @jthorton
    jthorton committed Sep 4, 2024
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Commits on Sep 5, 2024

  1. update unit type hints, add dict round trip test

    @jthorton
    jthorton committed Sep 5, 2024
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  2. update doc string

    @jthorton
    jthorton committed Sep 5, 2024
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Commits on Sep 10, 2024

  1. update perses atom mapper to use openff units

    @jthorton
    jthorton committed Sep 10, 2024
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Commits on Sep 16, 2024

  1. Update test_perses_atommapper.py

    @IAlibay
    IAlibay committed Sep 16, 2024
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  2. add news

    @jthorton
    jthorton committed Sep 16, 2024
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  3. Merge remote-tracking branch 'origin/perses_mapper' into perses_mapper

    @jthorton
    jthorton committed Sep 16, 2024
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