A community-powered search of machine learning strategy space to find NMR property prediction models.
Bratholm LA, Gerrard W, Anderson B, Bai S, Choi S, Dang L, Hanchar P, Howard A, Kim S, Kolter Z, Kondor R, Kornbluth M, Lee Y, Lee Y, Mailoa JP, Nguyen TT, Popovic M, Rakocevic G, Reade W, Song W, Stojanovic L, Thiede EH, Tijanic N, Torrubia A, Willmott D, Butts CP, Glowacki DR.
Bratholm LA, et al. Among authors: choi s.
PLoS One. 2021 Jul 20;16(7):e0253612. doi: 10.1371/journal.pone.0253612. eCollection 2021.
PLoS One. 2021.
PMID: 34283864
Free PMC article.