Protein

PyDockEneRes: per-residue decomposition of protein-protein docking energy

1 month ago   |   By Oxford Journals

AbstractMotivationProtein-protein interactions are key to understand biological processes at the molecular level. As a complement to experimental characterization of protein interactions, computational docking methods have become useful tools for the structural and energetics modeling of protein-protein complexes. A key aspect of such algorithms is the use of scoring functions to evaluate the generated docking poses and try to identify the best models. When the scoring functions are based on energetic considerations, they can help not only to provide a reliable structural model for the...
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