try removing xTB from the ARC env and bumpimg np

ReactionMechanismGenerator · May 13, 2023 · 9d929a2 · 9d929a2
1 parent 04c37b6
commit 9d929a2
Showing 1 changed file with 1 addition and 2 deletions.
diff --git a/environment.yml b/environment.yml
@@ -27,7 +27,7 @@ dependencies:
   - rmg::muq2
   - networkx
   - rmg::numdifftools
-  - numpy =1.20.1
+  - numpy =1.22.0
   - conda-forge::openbabel >= 3
   - pandas
   - psutil
@@ -57,5 +57,4 @@ dependencies:
   - mako
   - pytables
   - anaconda::pytest
-  - conda-forge::xtb
   - conda-forge::pytest-cov