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Add data structure to save and restart a simulation. #149

Merged
merged 11 commits into from
Jul 12, 2024
Merged

Add data structure to save and restart a simulation. #149

merged 11 commits into from
Jul 12, 2024

Commits on Jul 7, 2024

  1. add write and read simulation methods

    @chrisjonesBSU
    chrisjonesBSU committed Jul 7, 2024
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  2. add more doc strings

    @chrisjonesBSU
    chrisjonesBSU committed Jul 7, 2024
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  3. add unit test

    @chrisjonesBSU
    chrisjonesBSU committed Jul 7, 2024
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  4. add walls check to pickle_forcefield()

    @chrisjonesBSU
    chrisjonesBSU committed Jul 7, 2024
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  5. update versions in actions

    @chrisjonesBSU
    chrisjonesBSU committed Jul 7, 2024
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  6. fix wall check logic, add test

    @chrisjonesBSU
    chrisjonesBSU committed Jul 7, 2024
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Commits on Jul 9, 2024

  1. make forces into a list

    @chrisjonesBSU
    chrisjonesBSU committed Jul 9, 2024
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  2. Merge branch 'main' of github.com:cmelab/flowerMD into sim-json

    @chrisjonesBSU
    chrisjonesBSU committed Jul 9, 2024
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  3. possible work around for starting sim with walls

    @chrisjonesBSU
    chrisjonesBSU committed Jul 9, 2024
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Commits on Jul 12, 2024

  1. always include wall forces when pickling entire sim, remake them when… 

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    @chrisjonesBSU
    chrisjonesBSU committed Jul 12, 2024
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  2. update test to check for positions

    @chrisjonesBSU
    chrisjonesBSU committed Jul 12, 2024
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