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)
|
Title: Chemo-enzymatic routes towards the synthesis of bio-based monomers and polymers Year: 2019
Authors (3):
S. T. Ahmed, N. G. H. .Leferink, N. S. Scrutton
Publisher: Molecular Catalysis
DOI: 10.1016/j.mcat.2019.01.036 article-journal
Themes: Biocatalysis (2019)
|
Title: Multiscale Workflow for Modeling Ligand Complexes of Zinc Metalloproteins Year: 2021
Authors (8):
Z. Yang, R. M. Twidale, S. Gervasoni, R. Suardíaz, C. K. Colenso, E. J. M. .Lang, J. Spencer, A. J. Mulholland
Publisher: Journal of Chemical Information and Modeling
DOI: 10.1021/acs.jcim.1c01109 journal-article
Themes: Biocatalysis (2021)
|
Title: Advances in Upgrading Biomass to Biofuels and Oxygenated Fuel Additives Using Metal Oxide Catalysts Year: 2022
Authors (3):
J. Ethiraj, D. P. Wagh, H. G. Manyar
Publisher: Energy & Fuels
DOI: 10.1021/acs.energyfuels.1c03346 journal-article
Themes: Water-Energy (2022)
|
Title: CO2 capture over steam and KOH activated biochar: Effect of relative humidity Year: 2022
Authors (4):
C. Zhang, S. Sun, S. Xu, C. Wu
Publisher: Biomass and Bioenergy
DOI: 10.1016/j.biombioe.2022.106608 journal-article
Themes: Core (2022)
|
Title: Biocatalysis in ionic liquids for a low carbon future Year: 2022
Authors (3):
A. C. Marr, H. T. Imam, P. C. Marr
Publisher: Biocatalysis in Green Solvents
DOI: 10.1016/b978-0-323-91306-5.00016-9 book-chapter
Themes: Water-Energy (2022)
|