pin numpy to version<2 to prevent rdkit errors (deepchem#4013)

* pin numpy to <2 to prevent rdkit errors * fix pins of numpy
GreatRSingh · Jun 17, 2024 · d3491a0 · d3491a0
1 parent ebb7824
commit d3491a0
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Showing 4 changed files with 4 additions and 4 deletions.
diff --git a/requirements/env_common.yml b/requirements/env_common.yml
@@ -8,7 +8,7 @@ dependencies:
   - pdbfixer
   - pip
   - pip:
-    - numpy
+    - numpy==1.26.4
     - rdkit==2023.09.5
     - pre-commit
     - biopython

diff --git a/requirements/env_common_3_8.yml b/requirements/env_common_3_8.yml
@@ -8,7 +8,7 @@ dependencies:
   - pdbfixer
   - pip
   - pip:
-    - numpy
+    - numpy==1.24.4
     - rdkit==2023.09.5
     - pre-commit
     - biopython

diff --git a/requirements/env_dqc.yml b/requirements/env_dqc.yml
@@ -5,7 +5,7 @@ channels:
 dependencies:
  - pip
  - pip:
-   - numpy
+   - numpy==1.24.4
    - scipy
    - h5py
    - -f https://download.pytorch.org/whl/cpu/torch_stable.html

diff --git a/setup.py b/setup.py
@@ -72,7 +72,7 @@ def _get_version():
       },
       install_requires=[
           'joblib',
-          'numpy>=1.21',
+          'numpy<2',
           'pandas',
           'scikit-learn',
           'sympy',