try again with cdpkit now that the issues are fixed

Acellera · Dec 16, 2024 · 3955573 · 3955573
1 parent 1ba97b7
commit 3955573
Showing 1 changed file with 5 additions and 5 deletions.
diff --git a/.github/workflows/test_and_publish.yml b/.github/workflows/test_and_publish.yml
@@ -41,11 +41,11 @@ jobs:
           # scikit-learn, joblib, biopython are only used for rarely-used functions in smallmol
           conda install -y -q scikit-learn joblib biopython -c conda-forge
 
-      # - name: Install cdpkit
-      #   # if: ${{ matrix.os == 'ubuntu-latest' }}
-      #   run: |
-      #     # for testing CDPKit SmallMol
-      #     pip install CDPKit==1.2.0.dev3
+      - name: Install cdpkit
+        # if: ${{ matrix.os == 'ubuntu-latest' }}
+        run: |
+          # for testing CDPKit SmallMol
+          pip install CDPKit==1.2.0.dev3
 
       - name: Install moleculekit
         run: |