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Reimplement OpenBabel::OBRandom as a wrapper of std::mt19937_64 #2241

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Reimplement OpenBabel::OBRandom as a wrapper of std::mt19937_64 #2241

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Commits on Jun 23, 2024

  1. chore: remove unnecessary forward declaration

    @e-kwsm
    e-kwsm committed Jun 23, 2024
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  2. chore: do not use pointer unnecessarily

    @e-kwsm
    e-kwsm committed Jun 23, 2024
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  3. refactor: use std::unique_ptr for OpenBabel::OBConformerSearch::d

    @e-kwsm
    e-kwsm committed Jun 23, 2024
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  4. feat: add PRNG-related methods to OpenBabel::OBRandom 

    - UniformInt
- UniformReal
- Normal
- Bernoulli
    @e-kwsm
    e-kwsm committed Jun 23, 2024
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  5. refactor: use newly-added OpenBabel::OBRandom methods

    @e-kwsm
    e-kwsm committed Jun 23, 2024
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  6. feat: implement OpenBabel::OBRandomMT as a wrapper of std::mt19937_64 

    deprecates OpenBabel::OBRandom
    @e-kwsm
    e-kwsm committed Jun 23, 2024
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  7. refactor: improve method to generate 3-D random unit vector 

    this is enabled if OB_USE_IMPROVED_RANDOM_UNIT_VECTOR, which defaults to
whether OpenBabel 4 is released or not, is defined as truthy
    @e-kwsm
    e-kwsm committed Jun 23, 2024
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  8. refactor: switch to OBRandomMT if OB_USE_OBRANDOMMT is defined as truthy 

    the macro defaults to whether OpenBabel 4 is released or not
    @e-kwsm
    e-kwsm committed Jun 23, 2024
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  9. docs: add explanations of OB_RANDOM_SEED environment variable

    @e-kwsm
    e-kwsm committed Jun 23, 2024
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