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New workflow schema
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JosePizarro3 committed Oct 10, 2024
1 parent c75d16e commit 963022f
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4 changes: 2 additions & 2 deletions pyproject.toml
Original file line number Diff line number Diff line change
Expand Up @@ -28,8 +28,8 @@ maintainers = [
]
license = { file = "LICENSE" }
dependencies = [
"nomad-lab@git+https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR.git@ea0e5cbc632a514ea4d7e0bca1fab105d452f94c",
"nomad-simulations@git+https://github.com/nomad-coe/nomad-simulations.git@6a7668bcda0c074f8696eddccf326973acff41ac",
"nomad-lab@git+https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR.git@6b7149a71b2999abbb2225fcb67a5acafc811806",
"nomad-simulations@git+https://github.com/nomad-coe/nomad-simulations.git@0732ea7c9d4c5afcc8b01e3dbfd9235cfc7ffe4c",
"python-magic-bin; sys_platform == 'win32'",
]

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2 changes: 1 addition & 1 deletion src/nomad_parser_vasp/parsers/parser.py
Original file line number Diff line number Diff line change
Expand Up @@ -52,5 +52,5 @@ def parse(

# Workflow section
workflow = SinglePoint()
workflow.normalize(archive=archive, logger=logger)
# workflow.normalize(archive=archive, logger=logger)
archive.workflow2 = workflow

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Coverage

Coverage Report
FileStmtsMissCoverMissing
src/nomad_parser_vasp/parsers
   __init__.py9278%20–22
   parser.py301743%7–10, 31–56
src/nomad_parser_vasp/schema_packages
   __init__.py8275%9–11
   schema_package.py18180%1–38
TOTAL653940% 

Tests Skipped Failures Errors Time
1 0 💤 0 ❌ 0 🔥 13.161s ⏱️

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