init_code

2024-01-29 19:49:14 -05:00
parent 353d892291
commit 91727d2500
29 changed files with 3623 additions and 1 deletions
--- a/requirements.txt
+++ b/requirements.txt
@@ -0,0 +1,17 @@
+fcd_torch==1.0.7
+hydra-core==1.3.2
+imageio==2.26.0
+joblib==1.2.0
+matplotlib==3.7.0
+mini_moses==1.0
+networkx==3.0
+numpy==1.24.2
+omegaconf==2.3.0
+pandas==1.5.3
+pytorch_lightning==2.0.1
+rdkit==2023.9.4
+scikit_learn==1.2.1
+torch==2.0.0
+torch_geometric==2.3.0
+torchmetrics==0.11.4
+tqdm==4.64.1