Hierarchical Quantum Embedding by Machine Learning for Large Molecular Assemblies
基于机器学习的分层量子嵌入方法在大型分子组装中的应用
期刊:Journal of Chemical Theory and Computation
影响因子:5.5
doi:10.1021/acs.jctc.5c00389
Bensberg, Moritz; Eckhoff, Marco; Husistein, Raphael T; Teynor, Matthew S; Sora, Valentina; Bro-Jørgensen, William; Thomasen, F Emil; Krogh, Anders; Lindorff-Larsen, Kresten; Solomon, Gemma C; Weymuth, Thomas; Reiher, Markus
