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Accessible Surface Area calculations #4417

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Accessible Surface Area calculations #4417

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Commits on Jan 8, 2024

  1. Added as author

    JureCerar committed Jan 8, 2024
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  2. Added to changelog

    JureCerar committed Jan 8, 2024
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  3. Added 'documentation'

    JureCerar committed Jan 8, 2024
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  4. Implementation of SASA/RSASA calculation with Shrake-Rupley algorithm.

    JureCerar committed Jan 8, 2024
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  5. Renamed functions

    JureCerar committed Jan 8, 2024
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  6. Added tests

    JureCerar committed Jan 8, 2024
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  7. Added relevant references

    JureCerar committed Jan 8, 2024
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  8. Minor fixes

    JureCerar committed Jan 8, 2024
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  9. Fixed line length issue

    JureCerar committed Jan 8, 2024
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  10. Fixed pi issue

    JureCerar committed Jan 8, 2024
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  11. Fixed line length issue

    JureCerar committed Jan 8, 2024
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  12. Fixed type in docs

    JureCerar committed Jan 8, 2024
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  13. Merge branch 'develop' into sasa

    @JureCerar
    JureCerar authored Jan 8, 2024
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  14. Fixed bug with dictionary

    JureCerar committed Jan 8, 2024
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  15. Added tests for errors and warnings

    JureCerar committed Jan 8, 2024
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Commits on Jan 9, 2024

  1. Merge branch 'sasa' of https://github.com/JureCerar/mdanalysis into sasa

    JureCerar committed Jan 9, 2024
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Commits on Jan 15, 2024

  1. Merge branch 'MDAnalysis:develop' into sasa

    @JureCerar
    JureCerar authored Jan 15, 2024
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Commits on Jan 17, 2024

  1. Fixed PEP8 spaces issue

    JureCerar committed Jan 17, 2024
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Commits on Jul 9, 2024

  1. Sync?

    @JureCerar
    JureCerar committed Jul 9, 2024
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  2. Merge branch 'develop' into sasa

    @JureCerar
    JureCerar authored Jul 9, 2024
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  3. Changed to iterate over resindices rather than resids

    @JureCerar
    JureCerar committed Jul 9, 2024
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  4. Corrected the changelog and authors

    @JureCerar
    JureCerar committed Jul 9, 2024
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