DLKcat

DLKcat support is available under pipeGEM.extensions.DLKcat for kcat prediction workflows.

Install optional dependencies before importing the extension:

pip install -e ".[dlkcat]"

Then use the extension APIs:

from pipeGEM.extensions.DLKcat import predict_Kcat

predictions = predict_Kcat(...)

The extension requires PyTorch and RDKit. Keep DLKcat imports isolated from general workflows if those optional dependencies are not installed.