Open Access Publications at MPI Magdeburg

Journal Article (96)

2018
Journal Article
Akram, N.; Qamar, S.; Seidel-Morgenstern, A.: Nonlinear model of liquid chromatography considering finite rates of adsorption-desorption kinetics and core-shell adsorbents. Journal of Liquid Chromatography & Related Technologies 41 (17-18), pp. 964 - 972 (2018)
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Antoulas, A. C.; Benner, P.; Feng, L.: Model Reduction by Iterative Error System Approximation. Mathematical and Computer Modelling of Dynamical Systems 24 (2), pp. 103 - 118 (2018)
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Antoulas, A. C.; Zhu, B.; Zhang, Q.; York, B.; O'Malley, B. W.; Dacso, C. C.: A novel mathematical method for disclosing oscillations in gene transcription: A comparative study. PLoS ONE 13 (9), e0198503 (2018)
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Aydin, E.; Bonvin, D.; Sundmacher, K.: NMPC using Pontryagin’s Minimum Principle-Application to a two-phase semi-batch hydroformylation reactor under uncertainty. Computers and Chemical Engineering 108, pp. 47 - 56 (2018)
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Aydin, E.; Bonvin, D.; Sundmacher, K.: Computationally efficient NMPC for batch and semi-batch processes using parsimonious input parameterization. Journal of Process Control 66, pp. 12 - 22 (2018)
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Baran, B.; Benner, P.; Heiland, J.; Saak, J.: Optimal Control of a Stefan Problem Fully Coupled with Incompressible Navier-Stokes-Equations and Mesh Movement. Analele Stiintifice ale Universitatii Ovidius Constanta - Seria Matematica 26 (2), pp. 11 - 40 (2018)
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Baumann, M.; Astudillo, R.; Qiu, Y.; Ang, E. Y. M.; van , v. G.; Plessix, R.-E.: An MSSS-preconditioned Matrix Equation Approach for the Time-Harmonic Elastic Wave Equation at Multiple Frequencies. Computational Geosciences 22 (1), pp. 43 - 61 (2018)
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Baumann, M.; Benner, P.; Heiland, J.: Space-time Galerkin POD with Application in Optimal Control of Semi-Linear Parabolic Partial Differential Equations. SIAM Journal on Scientific Computing 40 (3), pp. A1611 - A1641 (2018)
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Beneyton, T.; Krafft, D.; Bednarz, C.; Kleineberg, C.; Wölfer, C.; Ivanov, I.; Vidaković-Koch, T.; Sundmacher, K.; Baret, J.-C.: Out-of-equilibrium microcompartments for the bottom-up integration of metabolic functions. Nature Communications 9, 2391 (2018)
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Benner, P.; Bujanović, Z.; Kürschner, P.; Saak, J.: RADI: a Low-Rank ADI-Type Algorithm for Large Scale Algebraic Riccati Equations. Numerische Mathematik 138 (2), pp. 301 - 330 (2018)
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Benner, P.; Goyal, P. K.; Gugercin, S.: H2-Quasi-Optimal Model Order Reduction for Quadratic-Bilinear Control Systems. SIAM Journal on Matrix Analysis and Applications 39 (2), pp. 983 - 1032 (2018)
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Benner, P.; Heiland, J.: Exponential Stability and Stabilization of Extended Linearizations via Continuous Updates of Riccati Based Feedback. International Journal of Robust and Nonlinear Control 28 (4), pp. 1218 - 1232 (2018)
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Benner, P.; Himpe, C.; Mitchell, T.: On Reduced Input-Output Dynamic Mode Decomposition. Advances in Computational Mathematics 44 (6), pp. 1751 - 1768 (2018)
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Benner, P.; Khoromskaia, V.; Khoromskij, B. N.: Range-Separated Tensor Format for Many-Particle Modeling. SIAM Journal on Scientific Computing 40 (2), pp. A1034 - A1062 (2018)
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Benner, P.; Lowe, R.; Voigt, M.: L-Norm Computation for Large-Scale Descriptor Systems Using Structured Iterative Eigensolvers. Numerical Algebra, Control and Optimization 8 (1), pp. 119 - 133 (2018)
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Benner, P.; Mena, H.: Numerical Solution of the Infinite-Dimensional LQR Problem and the Associated Riccati Differential Equations. Journal of Numerical Mathematics 26 (1), pp. 1 - 20 (2018)
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Benner, P.; Mitchell, T.: Faster and More Accurate Computation of the H Norm via Optimization. SIAM Journal on Scientific Computing 40 (5), pp. A3609 - A3635 (2018)
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Benner, P.; Qiu, Y.; Stoll, M.: Low-Rank Eigenvector Compression of Posterior Covariance Matrices for Linear Gaussian Inverse Problems. SIAM/ASA Journal on Uncertainty Quantification 6 (2), pp. 965 - 989 (2018)
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Benner, P.; Trautwein, C.: A Linear Quadratic Control Problem for the Stochastic Heat Equation Driven by Q-Wiener Processes. Journal of Mathematical Analysis and Applications 457 (1), pp. 776 - 802 (2018)
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Bosch, J.; Kahle, C.; Stoll, M.: Preconditioning of a Coupled Cahn-Hilliard Navier-Stokes system. Communications in Computational Physics 23, pp. 603 - 628 (2018)
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Bosch, J.; Klamt, S.; Stoll, M.: Generalizing diffuse interface methods on graphs: non-smooth potentials and hypergraphs. SIAM Journal on Applied Mathematics 78 (3), pp. 1350 - 1377 (2018)
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Boz, E.; Tüzün, N. S.; Stein, M.: Computational investigation of the control of the thermodynamics and microkinetics of the reductive amination reaction by solvent coordination and a co-catalyst. RSC Advances 8, pp. 36662 - 36674 (2018)
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Buchbinder, J. H.; Pischel, D.; Sundmacher, K.; Flassig, R.; Lavrik, I. N.: Quantitative single cell analysis uncovers the life/death decision in CD95 network. PLOS Computational Biology 14 (9), e1006368 (2018)
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Buchholz, H. K.; Stein, M.: Accurate Lattice Energies of Organic Molecular Crystals from Periodic Turbomole Calculations. Journal of Computational Chemistry 39 (19), pp. 1335 - 1343 (2018)
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Bystron, T.; Vesely, M.; Paidar, M.; Papakonstantinou, G.; Sundmacher, K.; Bensmann, B.; Hanke-Rauschenbach, R.; Bouzek, K.: Enhancing PEM water electrolysis efficiency by reducing the extent of Ti gas diffusion layer passivation. Journal of Applied Electrochemistry 48 (6), pp. 713 - 723 (2018)
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Carvalho, S. B.; Fortuna, A. R.; Wolff, M. W.; Peixoto, C.; Alves, P. M.; Reichl, U.; Carrondo, M. J. T.: Purification of influenza virus-like particles using sulfated cellulose membrane adsorbers. Journal of Chemical Technology and Biotechnology 93 (7), pp. 1988 - 1996 (2018)
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Chuzel, L.; Ganatra, M. B.; Rapp, E.; Henrissat, B.; Taron, C. H.: Functional metagenomics identifies an exosialidase with an inverting catalytic mechanism that defines a new glycoside hydrolase family (GH156). The Journal of Biological Chemistry 293, pp. 18138 - 18150 (2018)
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David, U. U.; Qamar, S.; Seidel-Morgenstern, A.: Analytical and numerical solutions of two-dimensional general rate models for liquid chromatographic columns packed with core–shell particles. Chemical Engineering Research and Design 130, pp. 295 - 320 (2018)
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Dürr, R.; Waldherr, S.: A Novel Framework for Parameter and State Estimation of Multicellular Systems Using Gaussian Mixture Approximations. Processes 6 (10), 187 (2018)
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Escorcia Cabrera, A. M.; Stein, M.: QM/MM Investigation of the Role of a Second Coordination Shell Arginine in [NiFe]-Hydrogenases. Frontiers in Chemistry (6), 164 (2018)
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Fechtner, M.; Kienle, A.: Efficient simulation and equilibrium theory for adsorption processes with implicit adsorption isotherms – Ideal adsorbed solution theory. Chemical Engineering Science 177, pp. 284 - 292 (2018)
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Freitag, M. A.; Kürschner, P.; Pestana, J.: GMRES Convergence Bounds for Eigenvalue Problems. Computational Methods in Applied Mathematics 18 (2), pp. 203 - 222 (2018)
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Gerlach, M.; Kirschtowski, S.; Seidel-Morgenstern, A.; Hamel, C.: Kinetic Modeling of the Palladium-Catalyzed Isomerizing Methoxycarbonylation of 1-Decene. Chemie-Ingenieur-Technik 90 (5), pp. 673 - 678 (2018)
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Golovin, I.; Strenzke, G.; Dürr, R.; Palis, S.; Bück, A.; Kienle, A.; Tsotsas, E.: Parameter Identification for Continuous Fluidized Bed Spray Agglomeration. Processes 6 (12), 246 (2018)
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Gosea, I. V.; Petreczky, M.; Antoulas, A. C.: Data-Driven Model Order Reduction of Linear Switched Systems in the Loewner Framework. SIAM Journal on Scientific Computing 40 (2), pp. B572 - B610 (2018)
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Gosea, I. V.; Antoulas, A. C.: Data‐driven model order reduction of quadratic‐bilinear systems. Numerical Linear Algebra with Applications: Special Issue: 7th Workshop on Matrix Equations and Tensor Techniques 25 (6), e2200 (2018)
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Gosea, I. V.; Petreczky, M.; Antoulas, A. C.; Fiter, C.: Balanced truncation for linear switched systems. Advances in Computational Mathematics 44 (6), pp. 1845 - 1886 (2018)
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Hädicke, O.; Kamp von, A.; Aydogan, T.; Klamt, S.: OptMDFpathway: Identification of metabolic pathways with maximal thermodynamic driving force and its application for analyzing the endogenous CO2 fixation potential of Escherichia coli. PLoS Computational Biology 14 (9), e1006492 (2018)
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Harder, B.-J.; Bettenbrock, K.; Klamt, S.: Temperature-dependent dynamic control of the TCA cycle increases volumetric productivity of itaconic acid production by Escherichia coli. Biotechnology and Bioengineering 115 (1), pp. 156 - 164 (2018)
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Himpe, C.: emgr - The Empirical Gramian Framework. Algorithms 11 (7), 91 (2018)
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Himpe, C.; Leibner, T.; Rave, S.: Hierarchical Approximate Proper Orthogonal Decomposition. SIAM Journal on Scientific Computing 40 (5), pp. A3267 - A3292 (2018)
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Hoffmann, M.; Pioch, M.; Pralow, A.; Hennig, R.; Kottler, R.; Reichl, U.; Rapp, E.: The Fine Art of Destruction: A Guide to In-Depth Glycoproteomic Analyses – Exploiting the Diagnostic Potential of Fragment Ions. Proteomics 18 (24), e1800282 (2018)
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Hund, M.; Saak, J.: A Connection between Time Domain Model Order Reduction and Moment Matching for LTI Systems. Mathematical and Computer Modelling of Dynamical Systems 24 (5), pp. 455 - 484 (2018)
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Immerz, C.; Paidar, M.; Papakonstantinou, G.; Bensmann, B.; Bystron, T.; Vidaković-Koch, T.; Bouzek, K.; Sundmacher, K.; Hanke-Rauschenbach, R.: Effect of the MEA design on the performance of PEMWE single cells with different sizes. Journal of Applied Electrochemistry 48 (6), pp. 701 - 711 (2018)
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Jongsma, H.-J.; Mlinarić, P.; Grundel, S.; Benner, P.; Trentelman, H. L.: Model Reduction of Linear Multi-Agent Systems by Clustering and with H2- and H-Error Bounds. Mathematics of Control, Signals, and Systems 30 (1), 6 (2018)
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Kaiser, N. M.; Flassig, R.; Sundmacher, K.: Reactor-Network Synthesis via Flux Profile Analysis. Chemical Engineering Journal 335, pp. 1018 - 1030 (2018)
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Klamt, S.; Mahadevan, R.; Hädicke, O.: When do two-stage processes outperform one-stage processes? Biotechnology Journal 13 (2), 1700539 (2018)
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Klamt, S.; Müller, S.; Regensburger, G.; Zanghellini, J.: A mathematical framework for yield (versus rate) optimization in constraint-based modeling and applications in metabolic engineering. Metabolic Engineering 47, pp. 153 - 169 (2018)
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Kotelnikova, E. N.; Isakov, A.; Lorenz, H.: Thermal deformations of crystal structures formed in the systems of malic acid enantiomers and L-valine–L-isoleucine enantiomers. CrystEngComm (20), pp. 2562 - 2572 (2018)
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Kumar, V.; Naumann, M.; Stein, M.: Computational Studies on the Inhibitor Selectivity of Human JAMM Deubiquitinylases Rpn11 and CSN5. Frontiers in Chemistry 6, 480 (2018)
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