fix: add networkx, lightning, transformers, torchmetrics

requirements.txt

@@ -9,6 +9,7 @@ torch-sparse
 torch-geometric
 torchvision==0.14.1
 torchaudio==0.12.1
+torchmetrics==0.11.4
 diffusers==0.6.0
 gt4sd>=1.4.2
 molgx>=0.22.0a1
@@ -25,6 +26,9 @@ numpy==1.23.5
 pandas>=1.0.0,<2.0.0
 pydantic>=2.0.0
 pydantic-settings>=2.0.0
+networkx==3.0
+pytorch-lightning==1.7.7
+transformers
 terminator @ git+https://github.com/IBM/regression-transformer@gt4sd
 guacamol_baselines @ git+https://github.com/GT4SD/[email protected]
 moses @ git+https://github.com/GT4SD/[email protected]