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Add helanal MDAKit #224

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Nov 15, 2024
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52 changes: 52 additions & 0 deletions mdakits/helanal/metadata.yaml
Original file line number Diff line number Diff line change
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project_name: helanal

authors:
- https://github.com/MDAnalysis/helanal/blob/main/AUTHORS.md

maintainers:
- fiona-naughton

description:
helanal contains code to analyse protein helicies based on their Cα atoms,
quantifying structural features such as local bending angles and global axes.

keywords:
- protein
- structure
- helix

license: GPL-2.0-or-later

project_home: https://github.com/MDAnalysis/helanal/

documentation_home: https://helanal.readthedocs.io

documentation_type: UserGuide + API

src_install:
- pip install git+https://github.com/MDAnalysis/helanal@main

install:
- pip install helanal

import_name: helanal

python_requires: ">=3.10"
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This doesn't match your conda-forge recipe.

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thanks for that catch - I've updated it to 3.10 on the conda-forge recipe


mdanalysis_requires: ">=2.0.0"

run_tests:
- pytest --pyargs helanal

test_dependencies:
- mamba install pytest MDAnalysisTests

project_org: MDAnalysis

development_status: Production/Stable

publications:
- https://doi.org/10.1002/bip.1967.360050708
- https://doi.org/10.1080/07391102.2000.10506570

changelog: https://github.com/MDAnalysis/helanal/blob/main/CHANGELOG.md
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