Comments (2)
Hi,
Thank you for your interest in our project.
Could you try change your working directory to ~/binding-ddg-predictor
and run the following command:
python ./scripts/predict.py ./data/example_wt.pdb ./data/example_mut.pdb
Thanks!
from binding-ddg-predictor.
thanks, the problem has been solved. what is the formula of ddg calculation in your tools? ddg=dgmut - dgwild or dgwild -dgmut
from binding-ddg-predictor.
Related Issues (9)
- Add license? HOT 2
- Details on the data and mutated PDB input
- About the model.pt
- Does the mutation sites are designed by manual? HOT 2
- Issue with running ddg-predictor
- how binding-ddg-predictor calculate ddg? HOT 2
- About the Rosetta relax
- What does a negative or positive ΔΔG calculated by binding-ddg-predictor mean?
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