Publications of Steffen Linke

König-Mattern, L.; Komarova, A. O.; Ghosh, A.; Linke, S.; Rihko-Struckmann, L.; Luterbacher, J.; Sundmacher, K.: High-throughput computational solvent screening for lignocellulosic biomass processing. Chemical Engineering Journal 452, 139476 (2023)

Sanchez Medina, E. I.; Linke, S.; Stoll, M.; Sundmacher, K.: Gibbs–Helmholtz graph neural network: capturing the temperature dependency of activity coefficients at infinite dilution. Digital Discovery 2 (3), pp. 781 - 798 (2023)

Hessel, V.; Tran, N. N.; Asrami, M. R.; Tran, Q. D.; Van Duc Long, N.; Escribà-Gelonch, M.; Tejada, J. O.; Linke, S.; Sundmacher, K.: Sustainability of green solvents – review and perspective. Green Chemistry 24, pp. 410 - 437 (2022)

Keßler, T.; Kunde, C.; Linke, S.; Sundmacher, K.; Kienle, A.: Integrated computer-aided molecular and process design: Green solvents for the hydroformylation of long-chain olefines. Chemical Engineering Science 249, 117243 (2022)

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)

König-Mattern, L.; Linke, S.; Rihko-Struckmann, L.; Sundmacher, K.: Computer-aided solvent screening for the fractionation of wet microalgae biomass. Green Chemistry 23, pp. 10014 - 10029 (2021)

Linke, S.; McBride, K.; Sundmacher, K.: Systematic Green Solvent Selection for the Hydroformylation of Long-Chain Alkenes. ACS Sustainable Chemistry & Engineering 8 (29), pp. 10795 - 10811 (2020)

Song, Z.; Hu, X.; Wu, H.; Mei, M.; Linke, S.; Zhou, T.; Qi, Z.; Sundmacher, K.: Systematic Screening of Deep Eutectic Solvents as Sustainable Separation Media Exemplified by the CO₂ Capture Process. ACS Sustainable Chemistry & Engineering 8 (23), pp. 8741 - 8751 (2020)

Zhou, T.; McBride, K.; Linke, S.; Song, Z.; Sundmacher, K.: Computer-aided solvent selection and design for efficient chemical processes. Current Opinion in Chemical Engineering 27, pp. 35 - 44 (2020)

Keßler, T.; Kunde, C.; Linke, S.; McBride, K.; Sundmacher, K.; Kienle, A.: Systematic Selection of Green Solvents and Process Optimization for the Hydroformylation of Long-Chain Olefines. Processes 7 (12), 882 (2019)

Kunde, C.; Keßler, T.; Linke, S.; McBride, K.; Sundmacher, K.; Kienle, A.: Surrogate Modeling for Liquid–Liquid Equilibria Using a Parameterization of the Binodal Curve. Processes (7), 753 (2019)

Sanchez Medina, E. I.; Linke, S.; Sundmacher, K.: Prediction of Bioconcentration Factors (BCF) using Graph Neural Networks. In: 31st European Symposium on Computer Aided Process Engineering, pp. 991 - 997 (Eds. Türkay, M.; Gani, R.). 31st European Symposium on Computer Aided Process Engineering, Istanbul, Turkey/virtual, June 06, 2021 - June 09, 2021. Elsevier, Amsterdam, Netherlands (2021)

Keßler, T.; Kunde, C.; Linke, S.; McBride, K.; Sundmacher, K.; Kienle, A.: Computer Aided Molecular Design of Green Solvents for the Hydroformylation of Long-Chain Olefines. ESCAPE 30, Virtual Symposium, August 31, 2020 - September 02, 2020. 30th European Symposium on Computer Aided Process Engineering: Computer Aided Chemical Engineering, pp. 745 - 750 (2020)

McBride, K.; Linke, S.; Xu, S.; Sundmacher, K.: Computer Aided Design of Green Thermomorphic Solvent Systems for Homogeneous Catalyst Recovery. In: 13th International Symposium on Process Systems Engineering (PSE 2018), pp. 1783 - 1788. 13th International Symposium on Process Systems Engineering (PSE 2018), San Diego, USA, July 01, 2018 - July 05, 2018. (2018)

König-Mattern, L.; Sanchez Medina, E. I.; Komarova, A. O.; Linke, S.; Rihko-Struckmann, L.; Luterbacher, J.; Sundmacher, K.: Tailored solvent design for lignin dissolution using graph neural networks. ECCE 14 & ECAB 7: 14th European Congress of Chemical Engineering and 7th European Congress of Applied Biotechnology, Berlin, Germany (2023)

König-Mattern, L.; Komarova, A.; Linke, S.; Rihko-Struckmann, L.; Luterbacher, J.; Sundmacher, K.: Computational solvent screening for the organosolv fractionation of lignocellulosic biomass. ISGC 2022: International Symposium on Green Chemistry, La Rochelle, France (2022)

König-Mattern, L.; Linke, S.; Rihko-Struckmann, L.; Sundmacher, K.: Lipid extraction in microalgal biorefineries: A COSMO-RS approach. 18th International Conference on Renewable Resources and Biorefineries, Bruges, Belgium (2022)

König-Mattern, L.; Linke, S.; Rihko-Struckmann, L.; Sundmacher, K.: Computational Solvent Screening for Efficient Microalgal-based Biorefineries exemplified by Phaeodactylum tricornutum. International Conference on Algal Biomass, Biofuels and Bioproducts (AlgalBBB 2021), Virtual (2021)

König-Mattern, L.; Linke, S.; Rihko-Struckmann, L.; Sundmacher, K.: Computational Solvent Screening for the Fractionation of Wet Microalgal Biomass Exemplified by Phaeodactylum tricornutum. ECCE 13 & ECAB 6: 13th European Congress of Chemical Engineering and 6th European Congress of Applied Biotechnology, Berlin, Virtual (2021)

Linke, S.; Jokiel, M.; McBride, K.; Sundmacher, K.: Green solvents for the hydroformylation of long chain alkenes. 2020 Virtual AIChE Annual Meeting, virtual (2020)

Kunde, C.; Keßler, T.; Linke, S.; McBride, K.; Sundmacher, K.; Kienle, A.: Global optimization of catalyst recovery in a thermomorphic multiphase system using surrogate models. 12th European Congress of Chemical Engineering – ECCE 12, Florence, Italy (2019)

Linke, S.; McBride, K.; Rätze, K.; Sundmacher, K.: Green Solvent Selection and Early Stage Process Design for the Homogeneously Catalyzed Reductive Amination of Long-chain Aldehydes. 12th European Congress of Chemical Engineering – ECCE 12, Florence, Italy (2019)

Linke, S.; McBride, K.; Sundmacher, K.: Green solvent selection for the homogeneously catalyzed hydroformylation of long-chain olefins in a thermomorphic solvent system. YCOPE 2019, Magdeburg, Germany (2019)

Rihko-Struckmann, L.; Sahni, A.; McBride, K.; Linke, S.; Sundmacher, K.: Algal remnant transformation to 5-HMF under biphasic conditions using a computationally predicted solvent selection approach. International Symposium on Green Chemistry 2019, La Rochelle , France (2019)

Linke, S.; McBride, K.; Xu, S.; Sundmacher, K.: "Green" solvent screening for thermomorphic solvent systems exemplified for hydroformylation. COSMO-RS-Symposium, Cologne, Germany (2018)

McBride, K.; Linke, S.; Xu, S.; Sundmacher, K.: Computer Aided Design of Green Thermomorphic Solvent Systems for Homogeneous Catalyst Recovery. PSE 2018 - 13th International Symposium on Process Systems Engineering, San Diego, USA (2018)

König-Mattern, L.; Linke, S.; Rihko-Struckmann, L.; Sundmacher, K.: Computer-aided solvent selection for the design of sustainable biorefinery processes. SmartProSys Symposium, Online (2022)

Sanchez Medina, E. I.; Linke, S.; Stoll, M.; Sundmacher, K.: Predicting Activity Coefficients at Infinite Dilution Using Hybrid Residual Graph Neural Networks. 2022 AIChE Annual Meeting, Phoenix, USA (2022)

Sanchez Medina, E. I.; Linke, S.; Sundmacher, K.: Prediction of Bioconcentration factors (BCF) using Graph Neural Networks. 31st European Symposium on Computer-Aided Process Engineering (ESCAPE-31), Istanbul, Turkey (2021)

McBride, K.; Linke, S.; Sundmacher, K.: Greener Solvents in Homogeneous Catalyst Recovery. ProcessNet-Jahrestagung und 33. DECHEMA-Jahrestagung der Biotechnologen 2018, Aachen, Germany (2018)