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Quantum.Ligand.Dock: protein–ligand docking with quantum entanglement refinement on a GPU system

Quantum.Ligand.Dock (protein–ligand docking with graphic processing unit (GPU) quantum entanglement refinement on a GPU system) is an original modern method for in silico prediction of protein–ligand interactions via high-performance docking code. The main flavour of our approach is a combination of...

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Detalles Bibliográficos
Autor principal: Kantardjiev, Alexander A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3394274/
https://www.ncbi.nlm.nih.gov/pubmed/22669908
http://dx.doi.org/10.1093/nar/gks515