Using Machine Learning to Greatly Accelerate Path Integral Ab Initio Molecular Dynamics

TitleUsing Machine Learning to Greatly Accelerate Path Integral Ab Initio Molecular Dynamics
Publication TypeJournal Article
Year of Publication2022
AuthorsLi, C, Voth, GA
JournalJ. Chem. Theory Comp.
Volume18
Issue2
Pagination599–604
Date Published02/2022
DOI10.1021/acs.jctc.1c01085
PubMed ID34982562
PubMed Central IDPMC8864787