Changed espaloma_charge dependency from pip-based to conda-based

timbernat · Jan 4, 2025 · 013949f · 013949f
1 parent fa74bad
commit 013949f
Showing 1 changed file with 4 additions and 3 deletions.
diff --git a/devtools/conda-envs/release-build.yml b/devtools/conda-envs/release-build.yml
@@ -48,8 +48,9 @@ dependencies:
     - openff-nagl>=0.4
     - openff-nagl-models>=0.3
 
+    # Espaloma
+    - espaloma_charge>=0.0.8
+
     # Chemical database queries
     - cirpy
-    - pubchempy
-    - pip:
-        - espaloma-charge>=0.0.8
+    - pubchempy