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Migrate to hoomd v4 #54

Merged
merged 14 commits into from
Sep 20, 2023
Merged

Migrate to hoomd v4 #54

merged 14 commits into from
Sep 20, 2023
+64 −24

Commits on Sep 19, 2023

  1. upgrade hoomd version to 4.1

    @marjanalbooyeh
    marjanalbooyeh committed Sep 19, 2023
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  2. Add thermostats types

    @marjanalbooyeh
    marjanalbooyeh committed Sep 19, 2023
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  3. add thermostat property to simulation

    @marjanalbooyeh
    marjanalbooyeh committed Sep 19, 2023
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  4. update thermostat setup.

    @marjanalbooyeh
    marjanalbooyeh committed Sep 19, 2023
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  5. update unit tests according to recent changes of simulation.

    @marjanalbooyeh
    marjanalbooyeh committed Sep 19, 2023
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Commits on Sep 20, 2023

  1. change NVE to constantVolume

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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  2. Merge branch 'main' into migrate-hoomd-v4

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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  3. add filter to gsdwriter

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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  4. flush gsdwriter

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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  5. upgrade to hoomd4.2

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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  6. pin hoomd version to 4.1

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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  7. Merge branch 'main' into migrate-hoomd-v4

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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  8. set default thermostat to MTTK

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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  9. use All filter for writer

    @marjanalbooyeh
    marjanalbooyeh committed Sep 20, 2023
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