Open Access Publications at MPI Magdeburg

Journal Article

Díaz Mirón, J.E.Z.; Stein, M.: A benchmark for non-covalent interactions in organometallic crystals. Physical Chemistry Chemical Physics 24, pp. 29338 - 29349 (2022)

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Journal Article

Duvigneau, S.; Dürr, R.; Wulkow, M.; Kienle, A.: Multiscale modeling of the microbial production of polyhydroxyalkanoates using two carbon sources. Computers and Chemical Engineering 160, 107740 (2022)

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Journal Article

Espinel-Rios, S.; Bettenbrock, K.; Klamt, S.; Findeisen, R.: Maximizing batch fermentation efficiency by constrained model-based optimization and predictive control of adenosine triphosphate turnover. AIChE-Journal 68 (4), e17555 (2022)

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Journal Article

Felischak, M.; Wolff, T.; Alvarado Perea, L.; Seidel-Morgenstern, A.; Hamel, C.: Evaluation of Catalysts for the Metathesis of Ethene and 2-Butene to Propene. catalysts 12 (2), 188 (2022)

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Journal Article

Göbel, S.; Kortum, F.; Chavez, K. J.; Jordan, I.; Sandig, V.; Reichl, U.; Altomonte, J.; Genzel, Y.: Cell-line screening and process development for a fusogenic oncolytic virus in small-scale suspension cultures. Applied Microbiology and Biotechnology 106, pp. 4945 - 4961 (2022)

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Journal Article

Gosea, I. V.: Exact and Inexact Lifting Transformations of Nonlinear Dynamical Systems: Transfer Functions, Equivalence, and Complexity Reduction. Applied Sciences 12 (5), 2333 (2022)

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Gosea, I. V.; Gugercin, S.: Data-driven modeling of linear dynamical systems with quadratic output in the AAA framework. Journal of Scientific Computing 91, 16 (2022)

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Journal Article

Gosea, I. V.; Gugercin, S.; Beattie, C.: Data-driven balancing of linear dynamical systems. SIAM Journal on Scientific Computing 44 (1), pp. A554 - A582 (2022)

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Journal Article

Goyal, P. K.; Benner, P.: Discovery of Nonlinear Dynamical Systems using a Runge-Kutta Inspired Dictionary-based Sparse Regression Approach. Proceedings of the Royal Society A 478 (2262), 20210883 (2022)

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Journal Article

Grundel, S.; Heyder, S.; Hotz, T.; Ritschel, T. K.S.; Sauerteig, P.; Worthmann, K.: How much testing and social distancing is required to control COVID-19? Some insight based on an age-differentiated compartmental model. SIAM Journal on Control and Optimization 60 (2), pp. S145 - S169 (2022)

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Journal Article

Guilbert, D.; Papakonstantinou, G.: Modeling, Degradation Study, Failures Diagnosis and Faulty Operating Management of Electrolyzers. Membranes 12, 1195 (2022)

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Journal Article

Hamel, C.; Seidel-Morgenstern, A.: Potenzial von Membranen zur verbesserten Reaktionsführung von Selektivoxidationen: Katalysator‐, Reaktor‐ und Prozessebene . Chemie Ingenieur Technik 94 (1-2), pp. 56 - 69 (2022)

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Journal Article

Heiland, J.; Benner, P.; Bahmani, R.: Convolutional Neural Networks for Very Low-dimensional LPV Approximations of Incompressible Navier-Stokes Equations. Frontiers in Applied Mathematics and Statistics, section Statistical and Computational Physics 8, 879140 (2022)

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supplementary-material

Journal Article

Heiland, J.; Unger, B.: Identification of linear time-invariant systems with Dynamic Mode Decomposition. mathematics 10 (3), 418 (2022)

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Journal Article

Hinterholzer, A.; Moises, J.; Regl, C.; Schwap, S.; Rapp, E.; Huber, C. G.; Schubert, M.: Unambiguous identification of α-Gal epitopes in intact monoclonal antibodies by NMR spectroscopy. mAbs 14 (1), 2132977 (2022)

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Journal Article

Hund, M.; Mitchell, T.; Mlinarić, P.; Saak, J.: Optimization-Based Parametric Model Order Reduction via H₂ ⊗ L₂ First-Order Necessary Conditions. SIAM Journal on Scientific Computing 44 (3), pp. A1554 - A1578 (2022)

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Journal Article

Jameel, F.; Stein, M.: The many roles of solvent in homogeneous catalysis - The reductive amination showcase. Journal of Catalysis 405, pp. 24 - 34 (2022)

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Journal Article

Kaim, V.; Joshi, M.; Stein, M.; Kaur-Ghumaan, S.: Mononuclear manganese complexes as hydrogen evolving catalysts. Frontiers in Chemistry 10, 993085 (2022)

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Journal Article

Khan, A.; Perveen, S.; Shaheen, Z.; Qamar, S.: Numerical approximation of non-linear chromatographic models considering Bi-Langmuir isotherm. Thermal Science 26 (1 Part A), pp. 77 - 93 (2022)

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Journal Article

Khattak, M. A.; Ahmad, M. I.; Feng, L.; Benner, P.: Multivariate Moment-Matching for Model Order Reduction of Quadratic-Bilinear Systems using Error Bounds. Advanced Modeling and Simulation in Engineering Sciences 9, 23 (2022)

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Journal Article

Khesali Aghtaei, H.; Püttker, S.; Maus, I.; Heyer, R.; Huang, L.; Sczyrba, A.; Reichl, U.; Benndorf, D.: Adaptation of a microbial community to demand-oriented biological methanation. Biotechnology for Biofuels and Bioproducts 15, 125 (2022)

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Journal Article

Klamt, S.; Kamp von, A.: Analyzing and Resolving Infeasibility in Flux Balance Analysis of Metabolic Networks. Metabolites 12 (7), 585 (2022)

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Journal Article

Klus, S.; Nüske, F.; Peitz, S.: Koopman analysis of quantum systems. Journal of Physics A 55, 314002 (2022)

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Journal Article

Kortuz, W.; Kirschtowski, S.; Seidel-Morgenstern, A.; Hamel, C.: Kinetics of the Rhodium‐Catalyzed Hydroaminomethylation of 1‐Decene in a Thermomorphic Solvent System. Chemie Ingenieur Technik 94 (5), pp. 760 - 765 (2022)

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Journal Article

Kuil, T.; Yayo, J.; Pechan, J.; Küchler, J.; van Maris, A. J. A.: Ethanol tolerance of Clostridium thermocellum: the role of chaotropicity, temperature and pathway thermodynamics on growth and fermentative capacity. Microbial Cell Factories 21, 273 (2022)

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Journal Article

Kumar, V.; Debbouche, A.; Nieto, J. J.: Existence, Stability and Controllability Results for a Class of Switched Evolution System with Impulses over Arbitrary Time Domain. Computational and Applied Mathematics 41 (8), 399 (2022)

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Journal Article

Kumar, V.; Kostić, M.; Tridane, A.; Debbouche, A.: Controllability of Switched Hilfer Neutral Fractional Dynamic Systems with Impulses. IMA Journal of Mathematical Control and Information 39 (3), pp. 807 - 836 (2022)

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post-print

Journal Article

Kumar, V.; Malik, M.; Baleanu, D.: Results on Hilfer Fractional Switched Dynamical System with Non-Instantaneous Impulses. Pramana: Journal of Physics 96 (4), 172 (2022)

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post-print

Journal Article

Lücke, M.; Nüske, F.: tgEDMD: Approximation of the Kolmogorov Operator in Tensor Train Format. Journal of Nonlinear Science 32, 44 (2022)

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Journal Article

Mahour, R.; Lee, J. W.; Grimpe, P.; Boecker, S.; Grote, V.; Klamt, S.; Seidel-Morgenstern, A.; Rexer, T.; Reichl, U.: Cell‐free multi‐enzyme synthesis and purification of uridine diphosphate galactose. ChemBioChem 23 (2), e202100361 (2022)

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Journal Article

Marušič, N.; Otrin, L.; Rauchhaus, J.; Zhao, Z.; Kyrilis, F. L.; Hamdi, F.; Kastritis, P. L.; Dimova, R.; Ivanov, I.; Sundmacher, K.: Increased efficiency of charge-mediated fusion in polymer/lipid hybrid membranes. Proceedings of the National Academy of Sciences 119 (20), e2122468119 (2022)

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Journal Article

Marušič, N.; Zhao, Z.; Otrin, L.; Dimova, R.; Ivanov, I.; Sundmacher, K.: Fusion‐Induced Growth of Biomimetic Polymersomes: Behavior of Poly(dimethylsiloxane)‐Poly(ethylene oxide) Vesicles in Saline Solutions Under High Agitation. Macromolecular Rapid Communications 43 (5), e2100712 (2022)

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Journal Article

Miličić, T.; Altaf, H.; Vorhauer-Huget, N.; Zivkovic, L.; Tsotsas, E.; Vidaković-Koch, T.: Modeling and Analysis of Mass Transport Losses of Proton Exchange Membrane Water Electrolyzer. Processes 10 (11), 2417 (2022)

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Journal Article

Misra, R.; Wisniewski, R.; Zuyev, A.: Attitude Stabilization of a Satellite Having Only Electromagnetic Actuation Using Oscillating Controls. Aerospace 9 (8), 444 (2022)

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Journal Article

Mitchell, T.; Overton, M. L.: On Properties of Univariate Max Functions at Local Maximizers. Optimization Letters 16, pp. 2527 - 2541 (2022)

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Journal Article

Möckel, M.; Baldok, N.; Walles, T.; Hartig, R.; Müller, A. J.; Reichl, U.; Genzel, Y.; Walles, H.; Wiese-Rischke, C.: Human 3D Airway Tissue Models for Real-Time Microscopy: Visualizing Respiratory Virus Spreading. Cells 11 (22), 3634 (2022)

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Journal Article

Natarajan, M.; Kumar, N.; Joshi, M.; Stein, M.; Kaur‐Ghumaan, S.: Mechanism of Diiron Hydrogenase Complexes Controlled by Nature of Bridging Dithiolate Ligand. ChemistryOpen 11 (1), e202100238 (2022)

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Journal Article

Offersgaard, A.; Duarte Hernandez, C. R.; Pihl, A. F.; Venkatesan, N. P.; Krarup, H.; Lin, X.; Reichl, U.; Bukh, J.; Genzel, Y.; Gottwein, J. M.: High-Titer Hepatitis C Virus Production in a Scalable Single-Use High Cell Density Bioreactor. Vaccines 10 (2), 249 (2022)

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Journal Article

Palitta, D.; Lefteriu, S.: An Efficient, Memory-Saving Approach for the Loewner Framework. Journal of Scientific Computing 91, 31 (2022)

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Journal Article

Palitta, D.; Pozza, S.; Simoncini, V.: The Short-term Rational Lanczos Method and Applications. SIAM Journal on Scientific Computing 44 (4), pp. A2843 - A2870 (2022)

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Journal Article

Papakonstantinou, G.; Spanos, I.; Dam, A. P.; Schlögl, R.; Sundmacher, K.: Electrochemical evaluation of the de-/re-activation of oxygen evolving Ir oxide. Physical Chemistry Chemical Physics 24 , pp. 14579 - 14591 (2022)

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Journal Article

Qin, H.; Song, Z.; Qi, Z.; Sundmacher, K.: Comparative screening of organic solvents, ionic liquids, and their binary mixtures for vitamin E extraction from deodorizer distillate. Chemical Engineering and Processing - Process Intensification 171, 108711 (2022)

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post-print

Journal Article

Qin, H.; Wang, Z.; Song, Z.; Zhang, X.; Zhou, T.: High-Throughput Computational Screening of Ionic Liquids for Butadiene and Butene Separation. Processes 10 (1), 165 (2022)

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Journal Article

Redmann, M.; Pontes Duff, I.: Full State Approximation by Galerkin Projection Reduced Order Models for Stochastic and Bilinear Systems. Applied Mathematics and Computation 420, 126561 (2022)

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Journal Article

Rodrigues Correia Ramos, J.; Bissinger, T.; Genzel, Y.; Reichl, U.: Impact of Influenza A Virus Infection on Growth and Metabolism of Suspension MDCK Cells Using a Dynamic Model. Metabolites 12 (3), 239 (2022)

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Journal Article

Saikia, B.; Seidel-Morgenstern, A.; Lorenz, H.: Multicomponent Materials to Improve Solubility: Eutectics of Drug Aminoglutethimide. Crystals 12 (1), 40 (2022)

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Journal Article

Sanchez Medina, E. I.; Linke, S.; Stoll, M.; Sundmacher, K.: Graph neural networks for the prediction of infinite dilution activity coefficients. Digital Discovery 1 (3), pp. 216 - 225 (2022)

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Journal Article

Schneider, P.; Bekiaris, P. S.; Kamp von, A.; Klamt, S.: StrainDesign: a Comprehensive Python Package for Computational Design of Metabolic Networks. Bioinformatics 38 (21), pp. 4981 - 4983 (2022)

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Journal Article

Schulze-Niemand, E.; Naumann, M.; Stein, M.: Substrate‐assisted activation and selectivity of the bacterial RavD effector deubiquitinylase. Proteins: Structure, Function, and Bioinformatics 90 (4), pp. 947 - 958 (2022)

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