Title: Enlighten2: molecular dynamics simulations of protein–ligand systems made accessible Year: 2020
Authors (2):
K. Zinovjev, M. W. van der Kamp
Publisher: Bioinformatics
DOI: 10.1093/bioinformatics/btaa643 article-journal
Themes: Biocatalysis (2020)
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Title: Benchmarking quantum mechanical methods for calculating reaction energies of reactions catalyzed by enzymes Year: 2020
Authors (5):
J. Sirirak, N. Lawan, M. W. van der Kamp, J. N. Harvey, A. J. Mulholland
Publisher: PeerJ Physical Chemistry
DOI: 10.7717/peerj-pchem.8 journal-article
Themes: Biocatalysis (2020)
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Title: Evolution of dynamical networks enhances catalysis in a designer enzyme Year: 2021
Authors (6):
H. A. Bunzel, J. L. . R. Anderson, D. Hilvert, V. L. Arcus, M. W. van der Kamp, A. J. Mulholland
Publisher: Nature Chemistry
DOI: 10.1038/s41557-021-00763-6 journal-article
Themes: Biocatalysis (2021)
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Title: Highly selective CO2 photoreduction to CO on MOF-derived TiO2 Year: 2023
Authors (13):
M. Garvin, W. A. Thompson, J. Z. Y. .Tan, S. Kampouri, C. P. Ireland, B. Smit, A. Brookfield, D. Collison, L. Negahdar, A. M. Beale, M. M. Maroto-Valer, R. D. McIntosh, S. Garcia
Publisher: RSC Sustainability
DOI: 10.1039/d2su00082b journal-article
Themes: New Catalysts (2023)
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