Update deps with confpass deps

pnnl · Apr 3, 2024 · b80b3e0 · b80b3e0
1 parent 4a0f7f4
commit b80b3e0
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diff --git a/conda-recipe/meta.yaml b/conda-recipe/meta.yaml
@@ -37,6 +37,9 @@ requirements:
     - snakemake >=6.3.0
     - statsmodels >=0.11.1
     - xtb >=6.5.1
+    - scikit-learn
+    - natsort
+    - networkx
     - pip:
       - git+https://github.com/jessbade/CONFPASS.git
 

diff --git a/envs/linux.yml b/envs/linux.yml
@@ -18,5 +18,8 @@ dependencies:
   - snakemake >=6.3.0
   - statsmodels >=0.11.1
   - xtb >=6.5.1
+  - scikit-learn
+  - natsort
+  - networkx
   - pip:
     - git+https://github.com/jessbade/CONFPASS.git
diff --git a/envs/osx.yml b/envs/osx.yml
@@ -16,5 +16,8 @@ dependencies:
   - snakemake >=6.3.0
   - statsmodels >=0.11.1
   - xtb >=6.5.1
+  - scikit-learn
+  - natsort
+  - networkx
   - pip:
     - git+https://github.com/jessbade/CONFPASS.git
diff --git a/requirements.txt b/requirements.txt
@@ -6,3 +6,6 @@ pandas >= 1.1.4
 snakemake >= 6.3.0
 statsmodels >= 0.11.1
 git+https://github.com/jessbade/CONFPASS.git
+scikit-learn
+natsort
+networkx