Search Results - "PLEISS, JÜRGEN"

Modeling Enzyme Kinetics: Current Challenges and Future Perspectives for Biocatalysis by Pleiss, Jürgen

“…Biocatalysis is becoming a data science. High-throughput experimentation generates a rapidly increasing stream of biocatalytic data, which is the raw material…”
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FAIR Data and Software: Improving Efficiency and Quality of Biocatalytic Science by Pleiss, Jürgen

“…Biocatalysis is entering a promising era as a data-driven science. High-throughput experimentation generates a rapidly increasing stream of biocatalytic data,…”
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Meta-analysis of viscosity of aqueous deep eutectic solvents and their components by Gygli, Gudrun, Xu, Xinmeng, Pleiss, Jürgen

“…Deep eutectic solvents (DES) formed by quaternary ammonium salts and hydrogen bond donors are a promising green alternative to organic solvents. Their high…”
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Beyond the Chemical Step: The Role of Substrate Access in Acyltransferase from Mycobacterium smegmatis by Carvalho, Henrique F., Mestrom, Luuk, Hanefeld, Ulf, Pleiss, Jürgen

“…Acyltransferase from Mycobacterium smegmatis is a versatile enzyme, which catalyzes the transesterification of esters in aqueous media due to a kinetic…”
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CANDy: Automated analysis of domain architectures in carbohydrate-active enzymes by Windels, Alex, Franceus, Jorick, Pleiss, Jürgen, Desmet, Tom

“…Carbohydrate-active enzymes (CAZymes) can be found in all domains of life and play a crucial role in metabolic and physiological processes. CAZymes often…”
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Effects of methanol on lipases: Molecular, kinetic and process issues in the production of biodiesel by Lotti, Marina, Pleiss, Jürgen, Valero, Francisco, Ferrer, Pau

“…The biotechnological production of biodiesel is based on transesterification/esterification reactions between a source of fatty acids and a short‐chain…”
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Binding of Solvent Molecules to a Protein Surface in Binary Mixtures Follows a Competitive Langmuir Model by Kulschewski, Tobias, Pleiss, Jürgen

“…The binding of solvent molecules to a protein surface was modeled by molecular dynamics simulations of of Candida antarctica (C. antarctica) lipase B in binary…”
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Analysis of Thermophysical Properties of Deep Eutectic Solvents by Data Integration by Xu, Xinmeng, Range, Jan, Gygli, Gudrun, Pleiss, Jürgen

“…Experimental data on thermophysical properties of solvent mixtures such as aqueous deep eutectic solvents (DES) are scattered in scientific publications. It is…”
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Enzymatic Production of Biodiesel: Strategies to Overcome Methanol Inactivation by Lotti, Marina, Pleiss, Jürgen, Valero, Francisco, Ferrer, Pau

“…Lipase‐catalyzed transesterification of triglycerides and alcohols to obtain biodiesel is an environmentally friendly and sustainable route for fuels…”
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Enzyme Toolbox: Novel Enantiocomplementary Imine Reductases by Scheller, Philipp N., Fademrecht, Silvia, Hofelzer, Sebastian, Pleiss, Jürgen, Leipold, Friedemann, Turner, Nicholas J., Nestl, Bettina M., Hauer, Bernhard

“…Reducing reactions are among the most useful transformations for the generation of chiral compounds in the fine‐chemical industry. Because of their exquisite…”
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Integration of Simulated and Experimentally Determined Thermophysical Properties of Aqueous Mixtures by ThermoML by Gültig, Matthias, Range, Jan P., Schmitz, Benjamin, Pleiss, Jürgen

“…In order to make thermophysical properties of complex liquid mixtures available to a comprehensive analysis, we developed a data management and analysis…”
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The GH19 Engineering Database: Sequence diversity, substrate scope, and evolution in glycoside hydrolase family 19 by Orlando, Marco, Buchholz, Patrick C. F, Lotti, Marina, Pleiss, Jürgen

“…The glycoside hydrolase 19 (GH19) is a bifunctional family of chitinases and endolysins, which have been studied for the control of plant fungal pests, the…”
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The PHA Depolymerase Engineering Database: A systematic analysis tool for the diverse family of polyhydroxyalkanoate (PHA) depolymerases by Knoll, Michael, Hamm, Thomas M, Wagner, Florian, Martinez, Virginia, Pleiss, Jürgen

“…Polyhydroxyalkanoates (PHAs) can be degraded by many microorganisms using intra- or extracellular PHA depolymerases. PHA depolymerases are very diverse in…”
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Conservation analysis of class-specific positions in cytochrome P450 monooxygenases: Functional and structural relevance by Gricman, Łukasz, Vogel, Constantin, Pleiss, Jürgen

“…ABSTRACT Cytochrome P450 monooxygenases (CYPs) constitute a ubiquitous, highly divergent protein family. Nevertheless, all CYPs share a common fold and…”
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Multicopper oxidases: modular structure, sequence space, and evolutionary relationships by Gräff, Maike, Buchholz, Patrick C. F., Le Roes‐Hill, Marilize, Pleiss, Jürgen

“…Multicopper oxidases (MCOs) use copper ions as cofactors to oxidize a variety of substrates while reducing oxygen to water. MCOs have been identified in…”
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Molecular Dynamics Simulations of Self-Emulsifying Drug-Delivery Systems (SEDDS): Influence of Excipients on Droplet Nanostructure and Drug Localization by Benson, Sven P, Pleiss, Jürgen

“…In this study, molecular dynamics (MD) simulations were applied to model the lipidic nanoscale droplets that form when self-emulsifying drug-delivery systems…”
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Bayesian estimation reveals that reproducible models in Systems Biology get more citations by Höpfl, Sebastian, Pleiss, Jürgen, Radde, Nicole E.

“…The Systems Biology community has taken numerous actions to develop data and modeling standards towards FAIR data and model handling. Nevertheless, the debate…”
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Asymmetric Enzymatic Hydration of Unactivated, Aliphatic Alkenes by Demming, Rebecca M., Hammer, Stephan C., Nestl, Bettina M., Gergel, Sebastian, Fademrecht, Silvia, Pleiss, Jürgen, Hauer, Bernhard

“…The direct enantioselective addition of water to unactivated alkenes could simplify the synthesis of chiral alcohols and solve a long‐standing challenge in…”
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Modelling of substrate access and substrate binding to cephalosporin acylases by Ferrario, Valerio, Fischer, Mona, Zhu, Yushan, Pleiss, Jürgen

“…Semisynthetic cephalosporins are widely used antibiotics currently produced by different chemical steps under harsh conditions, which results in a considerable…”
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Acceptance and Kinetic Resolution of α-Methyl-Substituted Aldehydes by Norcoclaurine Synthases by Roddan, Rebecca, Gygli, Gudrun, Sula, Altin, Méndez-Sánchez, Daniel, Pleiss, Jürgen, Ward, John M, Keep, Nicholas H, Hailes, Helen C

“…Norcoclaurine synthase (NCS) catalyzes a stereoselective Pictet–Spengler reaction to give the key intermediate, (S)-norcoclaurine in benzylisoquinoline…”
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