A dataset of protein-protein docking decoys from DIPS, analyzed with CCharppi

This dataset, derived from the DIPS database, was generated through a systematic process. Initially, PDB files were generated from protein pairs in their bound state. Subsequent to the dissociation of the complex, both components underwent random rotation. The resulting pairs were then employed to generate decoys using either FTDock or Lightdock. All docking decoys underwent thorough analysis in accordance with CAPRI standards, with subsequent assessment of the docking quality and the associated DockQ score. A subset of decoys, comprising an equivalent number of acceptable and incorrect instances, was selected for further analysis using the CCharppi function, yielding a comprehensive set of up to 159 features.