downgrade rdkit to 2020.03

yoshida-lab · Jan 27, 2021 · 5dce14b · 5dce14b
1 parent 9833fb8
commit 5dce14b
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Showing 7 changed files with 7 additions and 7 deletions.
diff --git a/.github/config/linux_win_env.yml b/.github/config/linux_win_env.yml
@@ -9,7 +9,7 @@ dependencies:
   - numpy
   - scipy
   - requests
-  - rdkit>=2020.09.1
+  - rdkit>=2020.03.1.0
   - 'libblas=*=*mkl'
   - scikit-learn
   - scipy

diff --git a/.github/config/macos_env.yml b/.github/config/macos_env.yml
@@ -9,7 +9,7 @@ dependencies:
   - numpy
   - scipy
   - requests
-  - rdkit>=2020.09.1
+  - rdkit>=2020.03.1.0
   - 'libblas=*=*mkl'
   - scikit-learn
   - scipy

diff --git a/conda_env/cpu.yml b/conda_env/cpu.yml
@@ -7,7 +7,7 @@ dependencies:
   - scikit-learn>=0.23.0
   - scipy>=1.5.2
   - pymatgen>=2020.10.9
-  - rdkit>=2020.09.1.0
+  - rdkit>=2020.03.1.0
   - 'libblas=*=*mkl'
   - jupyter>=1.0.0
   - pytorch >=1.6.0,<2.0.0

diff --git a/conda_env/cuda101.yml b/conda_env/cuda101.yml
@@ -7,7 +7,7 @@ dependencies:
   - scikit-learn>=0.23.0
   - scipy>=1.5.2
   - pymatgen>=2020.10.9
-  - rdkit>=2020.09.1.0
+  - rdkit>=2020.03.1.0
   - 'libblas=*=*mkl'
   - jupyter>=1.0.0
   - pytorch >=1.6.0,<2.0.0

diff --git a/conda_env/cuda102.yml b/conda_env/cuda102.yml
@@ -7,7 +7,7 @@ dependencies:
   - scikit-learn>=0.23.0
   - scipy>=1.5.2
   - pymatgen>=2020.10.9
-  - rdkit>=2020.09.1.0
+  - rdkit>=2020.03.1.0
   - 'libblas=*=*mkl'
   - jupyter>=1.0.0
   - pytorch >=1.6.0,<2.0.0

diff --git a/conda_env/cuda110.yml b/conda_env/cuda110.yml
@@ -7,7 +7,7 @@ dependencies:
   - scikit-learn>=0.23.0
   - scipy>=1.5.2
   - pymatgen>=2020.10.9
-  - rdkit>=2020.09.1.0
+  - rdkit>=2020.03.1.0
   - 'libblas=*=*mkl'
   - jupyter>=1.0.0
   - pytorch >=1.6.0,<2.0.0

diff --git a/conda_env/cuda92.yml b/conda_env/cuda92.yml
@@ -7,7 +7,7 @@ dependencies:
   - scikit-learn>=0.23.0
   - scipy>=1.5.2
   - pymatgen>=2020.10.9
-  - rdkit>=2020.09.1.0
+  - rdkit>=2020.03.1.0
   - 'libblas=*=*mkl'
   - jupyter>=1.0.0
   - pytorch >=1.6.0,<2.0.0