Title: Projector-Based Embedding Eliminates Density Functional Dependence for QM/MM Calculations of Reactions in Enzymes and Solution Year: 2019
Authors (8):
S. J. Bennie, N. Lawan, S. J. Macrae, F. R. Manby, A. J. Mulholland, K. E. Ranaghan, D. Shchepanovska, J. Zurek
Publisher: Journal of Chemical Information and Modeling
DOI: 10.1021/acs.jcim.8b00940 article-journal
Themes: Biocatalysis (2019)
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Title: Self-Limiting Growth of Two-Dimensional Palladium between Graphene Oxide Layers Year: 2019
Authors (12):
S. J. Haigh, C. Hardacre, C. Hu, K. Huang, V. G. Kravets, R. R. Nair, M. Neek-Amal, F. M. Peeters, E. Prestat, V. K. Puthiyapura, Y. Su, H. Xiao
Publisher: Nano Letters
DOI: 10.1021/acs.nanolett.9b01733 article-journal
Themes: Energy (2019)
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Title: Borylated N‐Heterocyclic Carbenes: Rearrangement and Chemical Trapping Year: 2019
Authors (9):
L. Kristinsdóttir, P. Vasko, H. Niu, E. L. Kolychev, J. Campos, M. ÁN. Fuentes, J. Hicks, A. L. Thompson, S. Aldridge
Publisher: Chemistry – A European Journal
DOI: 10.1002/chem.201804808 journal-article
Themes: Transformations (2019)
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