Thank you for this really cool project, as well as contributions to this area of computational drug discovery.
I actually have two questions but I split them into two issues so they can be addressed separately.
This first question is regarding DGL, which I am wondering is this a Graph Deep Learning library that is analogous to TorchGeometric? Is this being used as a substitute to TorchGeometric?
Also, I am running into this error
/opt/dgl/src/runtime/tensordispatch.cc:43: TensorDispatcher: dlopen failed: /home/joshua-talo/.conda/envs/equibind/lib/python3.8/site-packages/dgl/tensoradapter/pytorch/libtensoradapter_pytorch_1.10.2.so: cannot open shared object file: No such file or directory
Is there some dependency mismatch that I might be missing?
Hi Hannes,
Thank you for this really cool project, as well as contributions to this area of computational drug discovery.
I actually have two questions but I split them into two issues so they can be addressed separately.
This first question is regarding DGL, which I am wondering is this a Graph Deep Learning library that is analogous to TorchGeometric? Is this being used as a substitute to TorchGeometric?
Also, I am running into this error
/opt/dgl/src/runtime/tensordispatch.cc:43: TensorDispatcher: dlopen failed: /home/joshua-talo/.conda/envs/equibind/lib/python3.8/site-packages/dgl/tensoradapter/pytorch/libtensoradapter_pytorch_1.10.2.so: cannot open shared object file: No such file or directory
Is there some dependency mismatch that I might be missing?
Thank you.
Regards, Joshua