Merge pull request #364 from pyiron/conda_environment

Add support for conda environments again

Author: jan-janssen

.ci_support/environment-mpich.yml

@@ -5,6 +5,7 @@ dependencies:
 - numpy
 - mpich
 - cloudpickle =3.0.0
+- conda_subprocess =0.0.4
 - mpi4py =3.1.6
 - tqdm =4.66.4
 - pyzmq =26.0.3

.ci_support/environment-old.yml

@@ -5,6 +5,7 @@ dependencies:
 - numpy
 - openmpi =4.1.4
 - cloudpickle =2.0.0
+- conda_subprocess =0.0.3
 - mpi4py =3.1.4
 - tqdm =4.44.0
 - pyzmq =25.0.0

.ci_support/environment-openmpi.yml

@@ -5,6 +5,7 @@ dependencies:
 - numpy
 - openmpi
 - cloudpickle =3.0.0
+- conda_subprocess =0.0.4
 - mpi4py =3.1.6
 - tqdm =4.66.4
 - pyzmq =26.0.3

.ci_support/environment-win.yml

@@ -5,6 +5,7 @@ dependencies:
 - numpy
 - msmpi
 - cloudpickle =3.0.0
+- conda_subprocess =0.0.4
 - mpi4py =3.1.6
 - tqdm =4.66.4
 - pyzmq =26.0.3
@@ -13,4 +14,4 @@ dependencies:
 - matplotlib =3.8.4
 - networkx =3.3
 - pygraphviz =1.13
-- ipython =8.25.0
+- ipython =8.25.0

.github/workflows/unittest-flux-mpich.yml

@@ -29,6 +29,7 @@ jobs:
  shell: bash -l {0}
  timeout-minutes: 5
  run: |
+ conda create -y -n py312 python=3.12.1 pympipool
  pip install . --no-deps --no-build-isolation
  python -m unittest discover tests
  - name: Test Flux

.github/workflows/unittest-flux-openmpi.yml

@@ -29,6 +29,7 @@ jobs:
  shell: bash -l {0}
  timeout-minutes: 5
  run: |
+ conda create -y -n py312 python=3.12.1 pympipool
  pip install . --no-deps --no-build-isolation
  coverage run -a --omit="pympipool/_version.py,tests/*" -m unittest discover tests
  - name: Test Flux with OpenMPI

.github/workflows/unittest-mpich.yml

@@ -50,6 +50,7 @@ jobs:
  timeout-minutes: 5
  run: |
  pip install versioneer[toml]==0.29
+ conda create -y -n py312 python=3.12.1 pympipool
  pip install . --no-deps --no-build-isolation
  cd tests
  python -m unittest discover .

.github/workflows/unittest-openmpi.yml

@@ -50,6 +50,7 @@ jobs:
  timeout-minutes: 5
  run: |
  pip install versioneer[toml]==0.29
+ conda create -y -n py312 python=3.12.1 pympipool
  pip install . --no-deps --no-build-isolation
  cd tests
  python -m unittest discover .

.github/workflows/unittest-win.yml

@@ -32,6 +32,7 @@ jobs:
  timeout-minutes: 5
  run: |
  pip install versioneer[toml]==0.29
+ conda create -y -n py312 python=3.12.1 pympipool
  pip install . --no-deps --no-build-isolation
  cd tests
  python -m unittest discover .

.github/workflows/unittests-old.yml

@@ -27,6 +27,7 @@ jobs:
  timeout-minutes: 5
  run: |
  pip install versioneer[toml]==0.29
+ conda create -y -n py312 python=3.12.1 pympipool
  pip install . --no-deps --no-build-isolation
  cd tests
  python -m unittest discover .