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pro vyhledávání: '"Kirsopp, Josh John Mellor"'
Autor:
Kirsopp, Josh John Mellor, Di Paola, Cono, Manrique, David Zsolt, Krompiec, Michal, Greene-Diniz, Gabriel, Guba, Wolfgang, Meyder, Agnes, Wolf, Detlef, Strahm, Martin, Ramo, David Muñoz
We have demonstrated a prototypical hybrid classical and quantum computational workflow for the quantification of protein-ligand interactions. The workflow combines the Density Matrix Embedding Theory (DMET) embedding procedure with the Variational Q
Externí odkaz:
http://arxiv.org/abs/2110.08163