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‎CITATION.cff‎

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repository-code: "https://github.com/stfc/aiida-chemshell"
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abstract: "AiiDA plugin for the ChemShell multiscale computational chemistry package."
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license: BSD-3-Clause
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version: 0.1.13
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date-released: "2026-06-25"
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version: 0.1.14
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date-released: "2026-07-03"

‎pyproject.toml‎

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build-backend = "setuptools.build_meta"
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[project]
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version = "0.1.13"
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version = "0.1.14"
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name = "aiida-chemshell"
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description = "AiiDA workflow plugin for the ChemShell chemical modelling software package"
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authors = [

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