Dataset

We have constructed the dataset from MPAD database, with known wild-type and mutant ΔG values, and then calculated ΔΔG_(mut-wt) in kcal/mol. The training dataset consist of 770 mutations (including reverse mutations) and the external blind test set contains 86 single mutations. The data set with details on PDB ID, protein complex type, functional class, mutation and experimental binding affinity change (ΔΔG) is provided.

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