HeliXonProtein/binding-ddg-predictor

model.pt error

biotech70 opened this issue · 2 comments

biotech70 commented

during binding-ddg-predictior, I got the below error. model.pt file exists in the data directory.
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luost26 commented

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!

biotech70 commented

thanks, the problem has been solved. what is the formula of ddg calculation in your tools? ddg=dgmut - dgwild or dgwild -dgmut