Density Functional Theory-based Quantum Mechanics/Coarse-grained Molecular Mechanics: Theory and Implementation

TitleDensity Functional Theory-based Quantum Mechanics/Coarse-grained Molecular Mechanics: Theory and Implementation
Publication TypeJournal Article
Year of Publication2020
AuthorsMironenko, AV, Voth, GA
JournalJ. Chem. Theory Comp
Volume16
Issue10
Pagination6329–6342
Date Published10/2020
DOI10.1021/acs.jctc.0c00751
PubMed ID32877176