Utilizing Machine Learning to Greatly Expand the Range and Accuracy of Bottom-Up Coarse-Grained Models through Virtual Particles

TitleUtilizing Machine Learning to Greatly Expand the Range and Accuracy of Bottom-Up Coarse-Grained Models through Virtual Particles
Publication TypeJournal Article
Year of Publication2023
AuthorsSahrmann, PG, Loose, TD, Durumeric, AEP, Voth, GA
JournalJ. Chem. Theory Comput.
Volume19
Issue14
Pagination4402–4413
Date Published07/2023
DOI10.1021/acs.jctc.2c01183
PubMed ID36802592
PubMed Central IDPMC10373655