Merge pull request #1961 from glotzerlab/release-5.0

HOOMD-blue 5.0.0

.bumpversion.cfg

@@ -1,5 +1,5 @@
 [bumpversion]
-current_version = 4.9.1
+current_version = 5.0.0
 commit = False
 tag = False
 parse = ^(?P<major>0|[1-9]\d*)\.(?P<minor>0|[1-9]\d*)\.(?P<patch>0|[1-9]\d*)(?:-(?P<prerelease>(?:0|[1-9]\d*|\d*[a-zA-Z-][0-9a-zA-Z-]*))(?:\.(?P<number>0|[1-9]\d*|\d*[a-zA-Z-][0-9a-zA-Z-]*)))?$

.github/ISSUE_TEMPLATE/bug_report.yml

@@ -60,7 +60,7 @@ body:
     attributes:
       label: HOOMD-blue version
       description: What version of HOOMD-blue are you using?
-      placeholder: 4.9.1
+      placeholder: 5.0.0
     validations:
       required: true
   - type: markdown

.github/ISSUE_TEMPLATE/release.md

@@ -1,7 +1,7 @@
 ---
 name: Release checklist
 about: '[for maintainer use]'
-title: 'Release 4.9.1'
+title: 'Release 5.0.0'
 labels: ''
 assignees: 'joaander'
 
@@ -20,12 +20,13 @@ Minor and major releases:
 
 All releases:
 
-- [ ] Update change log.
-  - ``git log --format=oneline --first-parent $(git log -n 1 --pretty=format:%H -- CHANGELOG.rst)...``
+- [ ] Review change log.
 - [ ] Check readthedocs build, especially change log formatting.
 - [ ] Run *bumpversion*.
 - [ ] Tag and push.
 - [ ] Update conda-forge recipe.
 - [ ] Update *glotzerlab-software*.
 - [ ] Update *hoomd-component-template*.
+- [ ] Update *hoomd-md-pair-template*.
+- [ ] Update *hoomd-hpmc-shape-template*.
 - [ ] Update *hpmc-energy-template*.

.github/workflows/build_and_test.yaml

@@ -174,18 +174,6 @@ jobs:
       run: ninja install -j $(($(getconf _NPROCESSORS_ONLN) + 2)) -k 0
       working-directory: build
 
-    - name: Configure plugins
-      run : |
-        if [[ ${BUILD_DEBUG} == "true" ]]; then BUILD_TYPE="Debug"; else BUILD_TYPE="Release"; fi
-        echo "BUILD_TYPE=${BUILD_TYPE}"
-        CMAKE_PREFIX_PATH=${GITHUB_WORKSPACE}/install cmake -S code/example_plugins -B build-example-plugins -GNinja -DCMAKE_BUILD_TYPE=${BUILD_TYPE}
-      env:
-        BUILD_DEBUG: ${{ contains(inputs.config, 'debug') }}
-
-    - name: Build plugins
-      run: ninja install -j $(($(getconf _NPROCESSORS_ONLN) + 2)) -k 0
-      working-directory: build-example-plugins
-
     - name: Remove object files
       run: find build -type f -name '*.o' -delete
 
@@ -286,15 +274,15 @@ jobs:
     # requested, but no on the actual long validation tests. Every class's basic test should ensure
     # that the GPU kernel is called for at least a few timesteps for these checks to be effective.
     - name: Run memcheck
-      if: ${{ contains(inputs.config, 'cuda') && contains(github.event.pull_request.labels.*.name, 'validate') && inputs.validate == 'true' }}
+      if: ${{ contains(inputs.config, 'cuda') && contains(github.event.pull_request.labels.*.name, 'validate') && inputs.validate == 'true' && !contains(inputs.config, 'mpi')}}
       run: compute-sanitizer --tool memcheck --error-exitcode 1 python3 -m pytest --pyargs hoomd -x -v -ra --durations=0 --durations-min=0.1
 
     - name: Run racecheck
-      if: ${{ contains(inputs.config, 'cuda') && contains(github.event.pull_request.labels.*.name, 'validate') && inputs.validate == 'true' }}
+      if: ${{ contains(inputs.config, 'cuda') && contains(github.event.pull_request.labels.*.name, 'validate') && inputs.validate == 'true' && !contains(inputs.config, 'mpi')}}
       run: compute-sanitizer --tool racecheck --error-exitcode 1 python3 -m pytest --pyargs hoomd -x -v -ra --durations=0 --durations-min=0.1
 
     - name: Run synccheck
-      if: ${{ contains(inputs.config, 'cuda') && contains(github.event.pull_request.labels.*.name, 'validate') && inputs.validate == 'true' }}
+      if: ${{ contains(inputs.config, 'cuda') && contains(github.event.pull_request.labels.*.name, 'validate') && inputs.validate == 'true' && !contains(inputs.config, 'mpi')}}
       run: compute-sanitizer --tool synccheck --error-exitcode 1 python3 -m pytest --pyargs hoomd -x -v -ra --durations=0 --durations-min=0.1
 
     ### Validation tests

.github/workflows/environments/environment.yaml

@@ -1,5 +1,4 @@
 channels:
-- conda-forge/label/numpy_rc
 - conda-forge
 dependencies:
 - cereal
@@ -8,7 +7,7 @@ dependencies:
 - gsd
 - h5py
 - ninja
-- numpy>=2.0.0rc1
+- numpy>=2.0.0
 - mpi4py
 - openmpi
 - pybind11