Ewm7212 conda package (#4)

Complete, squashing

.github/workflows/package.yml

@@ -0,0 +1,51 @@
+name: conda packaging and deployment
+
+on:
+  workflow_dispatch:
+  push:
+    branches: [main]
+    tags: ['v*']
+  pull_request:
+
+jobs:
+  linux:
+    runs-on: ubuntu-latest
+    defaults:
+      run:
+        shell: bash -l {0}
+    steps:
+      - uses: actions/checkout@v4
+      - uses: conda-incubator/setup-miniconda@v3
+        with:
+          auto-update-conda: true
+          channels: conda-forge,defaults
+          use-mamba: true
+          environment-file: environment.yml
+          cache-environment-key: ${{ runner.os }}-env-${{ hashFiles('**/environment.yml') }}
+          cache-downloads-key: ${{ runner.os }}-downloads-${{ hashFiles('**/environment.yml') }}
+
+      - name: build and verify wheel
+        run: |
+          python -m build --wheel --no-isolation
+          check-wheel-contents dist/mantidprofiler-*.whl
+
+      - name: build conda package
+        run: |
+          # set up environment
+          cd conda.recipe
+          echo "versioningit $(versioningit ../)"
+          # build the package
+          VERSION=$(versioningit ../) conda mambabuild --channel conda-forge --output-folder . .
+          conda verify noarch/mantidprofiler*.tar.bz2
+      - name: upload conda package to anaconda
+        shell: bash -l {0}
+        if: startsWith(github.ref, 'refs/tags/v')
+        env:
+          ANACONDA_API_TOKEN: ${{ secrets.ANACONDA_TOKEN }}
+          IS_RC: ${{ contains(github.ref, 'rc') }}
+        run: |
+          # label is main or rc depending on the tag-name
+          CONDA_LABEL="main"
+          if [ "${IS_RC}" = "true" ]; then CONDA_LABEL="rc"; fi
+          echo pushing ${{ github.ref }} with label $CONDA_LABEL
+          anaconda upload --label $CONDA_LABEL conda.recipe/noarch/mantidprofiler*.tar.bz2

.pre-commit-config.yaml

@@ -8,6 +8,7 @@ repos:
     - id: check-added-large-files
       args: [--maxkb=8192]
     - id: check-yaml
+      exclude: "conda.recipe/meta.yaml"
     - id: end-of-file-fixer
     - id: trailing-whitespace
 - repo: https://github.com/astral-sh/ruff-pre-commit

conda.recipe/meta.yaml

@@ -0,0 +1,46 @@
+# load information from pyproject.toml
+{% set pyproject = load_file_data('pyproject.toml') %}
+{% set project = pyproject.get('project', {}) %}
+{% set license = project.get('license').get('text') %}
+{% set description = project.get('description') %}
+{% set project_url = pyproject.get('project', {}).get('urls') %}
+{% set url = project_url.get('homepage') %}
+# this will get the version set by environment variable
+{% set version = environ.get('VERSION') %}
+{% set version_number = version.split('+')[0] %}
+# change the build number by hand if you want to rebuild the package
+{% set build_number = 0 %}
+
+package:
+  name: mantidprofiler
+  version: {{ version_number }}
+
+source:
+  path: ..
+
+build:
+  noarch: python
+  number: {{ build_number }}
+  string: py{{py}}
+  script: {{ PYTHON }} -m pip install . --no-deps --ignore-installed -vvv
+
+requirements:
+  host:
+    - python
+    - versioningit
+    - setuptools>=42
+    - wheel
+
+  build:
+    - setuptools>=42
+    - versioningit
+
+  run:
+    - python
+
+about:
+  home: {{ url }}
+  license: {{ license }}
+  license_family: GPL
+  license_file: ../LICENSE
+  summary: {{ description }}

environment.yml

@@ -0,0 +1,18 @@
+name: mantid-profiler
+channels:
+  - conda-forge
+dependencies:
+  - anaconda-client
+  - boa
+  - check-wheel-contents
+  - conda-build < 4
+  - conda-verify
+  - libmamba
+  - libarchive
+  - pre-commit
+  - psutil
+  - python-build
+  - setuptools
+  - toml
+  - versioningit
+  - wheel

pyproject.toml

@@ -1,12 +1,40 @@
 [project]
 name = "mantidprofiler"
 description = "Uses psrecord and plotly.js to profile a mantid workflow"
+dynamic = ["version"]
 requires-python = ">=3.10"
 readme = "README.md"
 license = { text = "GPL3.0" }
 
+[project.urls]
+homepage = "https://github.com/mantidproject/mantid-profiler/"
+repository = "https://github.com/mantidproject/mantid-profiler/"
+issues = "https://github.com/mantidproject/mantid-profiler/issues"
+
 [build-system]
-requires = ["setuptools", "wheel", "toml"]
+requires = ["setuptools", "wheel", "toml", "versioningit"]
+build-backend = "setuptools.build_meta"
+
+[tool.setuptools.packages.find]
+where = ["src"]
+
+[tool.setuptools.package-data]
+"*" = ["*.yml","*.yaml","*.ini"]
+
+[tool.versioningit.vcs]
+method = "git"
+default-tag = "0.0.1"
+
+[tool.versioningit.next-version]
+method = "minor"
+
+[tool.versioningit.format]
+distance = "{next_version}.dev{distance}"
+dirty = "{version}+d{build_date:%Y%m%d}"
+distance-dirty = "{next_version}.dev{distance}+d{build_date:%Y%m%d%H%M}"
+
+[tool.versioningit.write]
+file = "src/mantidprofiler/_version.py"
 
 [tool.ruff]
 line-length = 120

diskrecord.py → src/mantidprofiler/diskrecord.py

@@ -4,7 +4,6 @@
 
 import numpy as np
 import psutil
-
 from time_util import get_current_time, get_start_time
 
 

mantid-profiler.py → src/mantidprofiler/mantidprofiler.py

@@ -20,9 +20,8 @@
 from pathlib import Path
 from threading import Thread
 
-import numpy as np
-
 import algorithm_tree as at
+import numpy as np
 from diskrecord import monitor as diskmonitor
 from diskrecord import parse_log as parse_disk_log
 from psrecord import monitor as cpumonitor

psrecord.py → src/mantidprofiler/psrecord.py

@@ -37,7 +37,6 @@
 
 import numpy as np
 import psutil
-
 from time_util import get_current_time, get_start_time