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6Modeling Enzyme Kinetics: Current Challenges and Future Perspectives for Biocatalysis
J. Pleiss. Biochemistry, 63 (20): 2533–2541 (2024)
2 months ago by @unibiblio
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1Supplementary material for "Influence of water content on thermophysical properties of aqueous glyceline solutions predicted by molecular dynamics simulations"
M. Spera, S. Darouich, J. Pleiss, and N. Hansen. Dataset, (2025)Related to: Spera, Marcelle B. M.; Darouich, Samir; Pleiss, Jürgen; Hansen, Niels (2025): Influence of water content on thermophysical properties of aqueous glyceline solutions predicted by molecular dynamics simulations. In: Fluid Phase Equilibria, 592, 114324. doi: 10.1016/j.fluid.2024.114324.
4 months ago by @unibiblio
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11Research Data Management in Simulation Science : Infrastructure, Tools, and Applications
B. Flemisch, S. Hermann, M. Herschel, D. Pflüger, J. Pleiss, J. Range, S. Roy, M. Takamoto, and B. Uekermann. Datenbank-Spektrum, 24 (2): 97-105 (2024)
4 months ago by @unibiblio
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2BioCatHub, a graphical user interface for standardized data acquisition in biocatalysis
S. Malzacher, J. Range, C. Halupczok, J. Pleiss, and D. Rother. Chemie - Ingenieur - Technik, 92 (9): 1251 (2020)
5 months ago by @unibiblio
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2Enzyme Modeling : From the Sequence to the Substrate Complex
S. Fademrecht, and J. Pleiss. Introduction to Enzyme Technology, Springer, Cham, (2024)
5 months ago by @unibiblio
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6CANDy : Automated analysis of domain architectures in carbohydrate-active enzymes
A. Windels, J. Franceus, J. Pleiss, and T. Desmet. PLOS ONE, (2024)
5 months ago by @unibiblio
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6Beyond the Chemical Step : The Role of Substrate Access in Acyltransferase from Mycobacterium smegmatis
H. Carvalho, L. Mestrom, U. Hanefeld, and J. Pleiss. ACS catalysis, 14 (13): 10077-10088 (2024)
6 months ago by @unibiblio
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1Biocatalytic stereocontrolled head-to-tail cyclizations of unbiased terpenes as a tool in chemoenzymatic synthesis
A. Schneider, T. Lystbæk, D. Markthaler, N. Hansen, and B. Hauer. Nature Communications, (2024)
6 months ago by @unibiblio
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6Discovery of NSD2 non-histone substrates and design of a super-substrate
S. Weirich, D. Kusevic, P. Schnee, J. Reiter, J. Pleiss, and A. Jeltsch. Communications biology, (2024)
7 months ago by @unibiblio
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2Fluent Integration of Laboratory Data into Biocatalytic Process Simulation Using EnzymeML, DWSIM, and Ontologies
A. Behr, J. Surkamp, E. Abbaspour, M. Häußler, S. Lütz, J. Pleiss, N. Kockmann, and K. Rosenthal. Processes, 12 (3): 597 (2024)
8 months ago by @unibiblio
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6Approaching the catalytic mechanism of protein lysine methyltransferases by biochemical and simulation techniques
P. Schnee, J. Pleiss, and A. Jeltsch. Critical reviews in biochemistry and molecular biology, (2024)
10 months ago by @unibiblio
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1Rieske Oxygenase-Catalyzed Oxidative Late-Stage Functionalization during Complex Antifungal Polyketide Biosynthesis
F. Guth, F. Lindner, S. Rydzek, A. Peil, S. Friedrich, B. Hauer, and F. Hahn. ACS chemical biology, 18 (12): 2450-2456 (2023)
11 months ago by @unibiblio
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6FAIR Data and Software: Improving Efficiency and Quality of Biocatalytic Science
J. Pleiss. ACS catalysis, 14 (4): 2709-2718 (2024)
12 months ago by @unibiblio
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1Controlling Monoterpene Isomerization by Guiding Challenging Carbocation Rearrangement Reactions in Engineered Squalene-Hopene Cyclases
J. Ludwig, C. Curado-Carballada, S. Hammer, A. Schneider, S. Diether, N. Kress, S. Ruiz-Barragan, S. Osuna, and B. Hauer. Angewandte Chemie. International edition, 63 (12): e202318913 (2024)
a year ago by @unibiblio
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1Additional data related to Weirich et al.: Discovery of new NSD2 non-histone substrates and design of a super-substrate
A. Jeltsch, P. Schnee, J. Pleiss, and S. Weirich. Software, (2024)Related to: Weirich S, Kusevic D, Schnee P, Reiter J, Pleiss J & Jeltsch A. Discovery of new NSD2 non-histone substrates and design of a super-substrate. Communications Biology 7:707 (2024). doi: 10.1038/s42003-024-06395-z.
a year ago by @unibiblio
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1Data for: 'EnzymeML-based modeling workflow: from raw data to kinetic parameters'
M. Häußler. Dataset, (2024)Related to: Häussler M, Prins A, Le Roes-Hill M, Wittig U, Pleiss, J. (2024) EnzymeML-based modeling workflow: from raw data to kinetic parameters. ChemCatChem.
a year ago by @unibiblio
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1Engineered cytochrome P450 for direct arylalkene-to-ketone oxidation via highly reactive carbocation intermediates
S. Gergel, J. Soler, A. Klein, K. Schuelke, B. Hauer, M. Garcia-Borràs, and S. Hammer. Nature catalysis, 6 (7): 606-617 (2023)
2 years ago by @unibiblio
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1A Career in Catalysis : Bernhard Hauer
B. Nebel, M. Breuer, A. Schneider, B. Aberle, S. Hammer, P. Syrén, M. Weissenborn, and B. Nestl. ACS catalysis, (2023)
2 years ago by @unibiblio
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2Alternative Active Site Confinement in Squalene-Hopene Cyclase Enforces Substrate Preorganization for Cyclization
K. Schell, H. Li, L. Lauterbach, K. Taizoumbe, J. Dickschat, and B. Hauer. ACS catalysis, 13 (7): 5073-5083 (2023)
2 years ago by @unibiblio
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2Methylation of Unactivated Alkenes with Engineered Methyltransferases To Generate Non-natural Terpenoids
B. Aberle, D. Kowalczyk, S. Massini, A. Egler-Kemmerer, S. Gergel, S. Hammer, and B. Hauer. Angewandte Chemie, 62 (26): e202301601 (2023)
2 years ago by @unibiblio
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6Modeling Enzyme Kinetics: Current Challenges and Future Perspectives for Biocatalysis

1Supplementary material for "Influence of water content on thermophysical properties of aqueous glyceline solutions predicted by molecular dynamics simulations"

11Research Data Management in Simulation Science : Infrastructure, Tools, and Applications

2BioCatHub, a graphical user interface for standardized data acquisition in biocatalysis

2Enzyme Modeling : From the Sequence to the Substrate Complex

6CANDy : Automated analysis of domain architectures in carbohydrate-active enzymes

6Beyond the Chemical Step : The Role of Substrate Access in Acyltransferase from Mycobacterium smegmatis

1Biocatalytic stereocontrolled head-to-tail cyclizations of unbiased terpenes as a tool in chemoenzymatic synthesis

6Discovery of NSD2 non-histone substrates and design of a super-substrate

2Fluent Integration of Laboratory Data into Biocatalytic Process Simulation Using EnzymeML, DWSIM, and Ontologies

6Approaching the catalytic mechanism of protein lysine methyltransferases by biochemical and simulation techniques

1Rieske Oxygenase-Catalyzed Oxidative Late-Stage Functionalization during Complex Antifungal Polyketide Biosynthesis

6FAIR Data and Software: Improving Efficiency and Quality of Biocatalytic Science

1Controlling Monoterpene Isomerization by Guiding Challenging Carbocation Rearrangement Reactions in Engineered Squalene-Hopene Cyclases

1Additional data related to Weirich et al.: Discovery of new NSD2 non-histone substrates and design of a super-substrate

1Data for: 'EnzymeML-based modeling workflow: from raw data to kinetic parameters'

1Engineered cytochrome P450 for direct arylalkene-to-ketone oxidation via highly reactive carbocation intermediates

1A Career in Catalysis : Bernhard Hauer

2Alternative Active Site Confinement in Squalene-Hopene Cyclase Enforces Substrate Preorganization for Cyclization

2Methylation of Unactivated Alkenes with Engineered Methyltransferases To Generate Non-natural Terpenoids

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