Articles with "set poses" as a keyword



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ViTScore: a novel three-dimensional Vision Transformer method for accurate prediction of protein-ligand docking poses.

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Published in 2023 at "IEEE transactions on nanobioscience"

DOI: 10.1109/tnb.2023.3274640

Abstract: Protein-ligand interactions (PLIs) are essential for cellular activities and drug discovery, and due to the complexity and high cost of experimental methods, there is a great demand for computational approaches, such as protein-ligand docking, to… read more here.

Keywords: native poses; ligand docking; near native; set poses ... See more keywords