Devops: Move package into src/ directory

This package directory structure is fast becoming the standard in the Python packaging community. Even though the PyPA is not yet officially recommending it as the standard, there are various articles out there outlining the advantages of this structure over having the source folder at the root of the repository.
aiidaplugins · Dec 22, 2023 · 24c443e · 24c443e
1 parent 6b17722
commit 24c443e
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Showing 8 changed files with 1 addition and 2 deletions.
diff --git a/.github/workflows/validate_release_tag.py b/.github/workflows/validate_release_tag.py
@@ -32,6 +32,6 @@ def get_version_from_module(content: str) -> str:
     args = parser.parse_args()
     assert args.GITHUB_REF.startswith('refs/tags/v'), f'GITHUB_REF should start with "refs/tags/v": {args.GITHUB_REF}'
     tag_version = args.GITHUB_REF[11:]
-    package_version = get_version_from_module(Path('aiida_wien2k/__init__.py').read_text(encoding='utf-8'))
+    package_version = get_version_from_module(Path('src/aiida_wien2k/__init__.py').read_text(encoding='utf-8'))
     error_message = f'The tag version `{tag_version}` is different from the package version `{package_version}`'
     assert tag_version == package_version, error_message
diff --git a/aiida_wien2k/__init__.py → src/aiida_wien2k/__init__.py b/aiida_wien2k/__init__.py → src/aiida_wien2k/__init__.py
diff --git a/aiida_wien2k/calculations/run123_lapw.py → src/aiida_wien2k/calculations/run123_lapw.py b/aiida_wien2k/calculations/run123_lapw.py → src/aiida_wien2k/calculations/run123_lapw.py
diff --git a/aiida_wien2k/configs/codes/run123_lapw.yml → ...iida_wien2k/configs/codes/run123_lapw.yml b/aiida_wien2k/configs/codes/run123_lapw.yml → ...iida_wien2k/configs/codes/run123_lapw.yml
diff --git a/aiida_wien2k/configs/computers/localhost.yml → ...da_wien2k/configs/computers/localhost.yml b/aiida_wien2k/configs/computers/localhost.yml → ...da_wien2k/configs/computers/localhost.yml
diff --git a/aiida_wien2k/parsers/scf123.py → src/aiida_wien2k/parsers/scf123.py b/aiida_wien2k/parsers/scf123.py → src/aiida_wien2k/parsers/scf123.py
diff --git a/aiida_wien2k/workflows/scf123_workchain.py → ...iida_wien2k/workflows/scf123_workchain.py b/aiida_wien2k/workflows/scf123_workchain.py → ...iida_wien2k/workflows/scf123_workchain.py
diff --git a/tests/calculations/test_scf123_lapw.py b/tests/calculations/test_scf123_lapw.py
@@ -6,7 +6,6 @@
 
 import pytest
 from aiida.orm import Dict, SinglefileData
-
 from aiida_wien2k.calculations.run123_lapw import Wien2kRun123Lapw
Original file line number	Diff line number	Diff line change
Expand Up		@@ -6,7 +6,6 @@

		import pytest
		from aiida.orm import Dict, SinglefileData

		from aiida_wien2k.calculations.run123_lapw import Wien2kRun123Lapw


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