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0.0.9

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@gph82 gph82 released this 05 Sep 17:11
· 38 commits to master since this release

[relase 0.0.8 was yanked because of small bug, we repeat the release notes here]
Most important changes:

  • Python 3.12 support added (see note on installation)

  • Consensus labels can now be used to streamline analysis across different sequences

    • to define neighborhoods
    • to define sequence-independent sites
    • to refine interface selections (see below)
    • as plot labels and as "sort_by" in plots
  • API BREAKs

    • Definition of interfaces is made easier with refactor:
      • frag_idxs_group_1, frag_idxs_group_2' become interface_selection_1, interface_selection_2
      • new parameter AA_selection, accepts flexible amino-acid selection
      • self_interface operates differently, simply deleting self-contacts if not set to True
    • Some added returned values of public methods (e.g. repframes and flareplot_attrs) might break existing code, but its easy to adapt
  • One new notebooks and new example datasets

  • See the full log for all changes

Relevant PRs

  • [python-package] add py312 by @gph82 in #50
  • Select by grn by @gph82 in #51
  • [nomenclature._sort_all_consensus_labels] API CHANGE return also sort… by @gph82 in #52

Full Changelog: 0.0.7...0.0.9