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2019

Sun Y.; Schemann A.; Held C.; Lu X.; Shen G.; Ji X.:

Modeling thermodynamic derivative properties and gas solubility of ionic liquids with ePC-SAFT

Industrial & Engineering Chemistry Research, 2019

https://dx.doi.org/10.0.3.253/acs.iecr.9b00254


Tsurko E. N.; Neueder R.; Held C.; Kunz W.:

Guanidinium Cation Effect on the Water Activity of Ternary (S)Aminopentanedioic Acid Sodium Salt Solutions at 298.15 and 310.15 K

Journal of Chemical & Engineering Data, vol. 64, pp. 1256-1264, 2019

https://dx.doi.org/10.1021/acs.jced.8b01142


Baz J.; Held C.; Pleiss J.; Hansen N.:

Thermophysical properties of glyceline–water mixtures investigated by molecular modelling

Physical Chemistry Chemical Physics, vol. 21, pp. 6467-6476, 2019

10.1039/c9cp00036d


Dietz C. H. J. T.; Creemers J. T.; Meuleman M. A.; Held C.; Sadowski G.; van Sint Annaland M.; Gallucci F.; Kroon:

Determination of the Total Vapor Pressure of Hydrophobic Deep Eutectic Solvents: Experiments and Perturbed-Chain Statistical Associating Fluid Theory Modeling

ACS Sustainable Chemistry & Engineering, vol. 7, pp. 4047-4057, 2019

https://dx.doi.org/10.1021/acssuschemeng.8b05449


Knierbein M; Held C; Hölzl C; Horinek D; Paulus M; Sadowski G; Sternemann C; Nase J:

Density variations of TMAO solutions in the kilobar range: Experiments, PCSAFT predictions, and molecular dynamics simulations

Biophysical Chemistry, vol. 253, 2019

https://doi.org/10.1016/j.bpc.2019.106222


Haarmann N.; Siewert R.; Samarov A. A.; Verevkin S. P.; Held C.; Sadowski G.:

Thermodynamic Properties of Systems Comprising Esters: Experimental Data and Modeling with PC-SAFT and SAFT-? Mie

Industrial & Engineering Chemistry Research, vol. 58, pp. 6841-6849, 2019

10.1021/acs.iecr.9b00714


Haarmann N.; Siewert R.; Samarov A. A.; Verevkin S. P.; Held C.; Sadowski G.:

Thermodynamic Properties of Systems Comprising Esters: Experimental Data and Modeling with PC-SAFT and SAFT-? Mie

Industrial & Engineering Chemistry Research, vol. 58, pp. 6841-6849, 2019

10.1021/acs.iecr.9b00714


Wolbert F; Brandenbusch C; Sadowski G:

Selecting Excipients Forming Therapeutic Deep Eutectic Systems?A Mechanistic Approach

Molecular Pharmaceutics, 2019

10.1021/acs.molpharmaceut.9b00336


Wangler A; Held C; Sadowski G:

Thermodynamic Activity-Based Solvent Design for Bioreactions

Trends in Biotechnology, vol. 37, pp. 1038-1041, 2019

https://doi.org/10.1016/j.tibtech.2019.07.001


Veith H; Schleinitz M; Schauerte C; Sadowski G:

Thermodynamic Approach for Co-crystal Screening

Crystal Growth & Design, 2019

https://doi.org/10.1021/acs.cgd.9b00103


Knierbein M; Venhuis M; Held C; Sadowski G:

Thermodynamic properties of aqueous osmolyte solutions at high-pressure conditions

Biophysical Chemistry, vol. 253, 2019

https://doi.org/10.1016/j.bpc.2019.106211


Haarmann M; Sosa A; Ortega J; Sadowski G:

Measurement and Prediction of Excess Properties of Binary Mixtures Methyl Decanoate + an Even-Numbered n?Alkane (C6?C16) at 298.15 K

Journal of Chemical & Engineering Data, 2019

10.1021/acs.jced.9b00185


Held C; Stolzke T; Knierbein M; Jaworek M W; Quan Luong T; Winter R; Sadowski G:

Cosolvent and pressure effects on enzyme-catalysed hydrolysis reactions

Biophysical Chemistry, vol. 252, 2019

https://doi.org/10.1016/j.bpc.2019.106209


Wysoczanska K.; Sadowski G.; Macedo E. A.; Held C.:

Toward Thermodynamic Predictions of Aqueous Vitamin Solubility: An Activity Coefficient-Based Approach

Industrial & Engineering Chemistry Research, vol. 58, pp. 7362-7369, 2019

10.1021/acs.iecr.9b00742


Wangler A.; Loll R.; Greinert T.; Sadowski G.; Held C.:

Predicting the high concentration co-solvent influence on the reaction equilibria of the ADH-catalyzed reduction of acetophenone

The Journal of Chemical Thermodynamics, vol. 128, pp. 275-282, 2019

10.1016/j.jct.2018.08.021


Wangler A.; Hüser A.; Sadowski G.; Held C.:

Simultaneous Prediction of Cosolvent Influence on Reaction Equilibrium and Michaelis Constants of Enzyme-Catalyzed Ketone Reductions

ACS Omega, vol. 4, pp. 6264-6272, 2019

10.1021/acsomega.8b03159


Schmolke L.; Lerch S.; Bülow M.; Siebels M.; Schmitz A.; Thomas J.; Dehm G.; Held C.; Strassner T.; Janiak C.:

Aggregation control of Ru and Ir nanoparticles by tunable aryl alkyl imidazolium ionic liquids

Nanoscale, vol. 11, pp. 4073-4082, 2019

10.1039/c8nr10286d


Dietz C. H. J. T.; Gallucci F.; van Sint Annaland M.; Held C.; Kroon M. C.:

110th Anniversary: Distribution Coefficients of Furfural and 5-Hydroxymethylfurfural in Hydrophobic Deep Eutectic Solvent + Water Systems: Experiments and Perturbed-Chain Statistical Associating Fluid Theory Predictions

Industrial & Engineering Chemistry Research, vol. 58, pp. 4240-4247, 2019

10.1021/acs.iecr.8b06234


Dietz C. H. J. T.; Erve A.; Kroon M. C.; van Sint Annaland M.; Gallucci F.; Held C.:

Thermodynamic properties of hydrophobic deep eutectic solvents and solubility of water and HMF in them: Measurements and PC-SAFT modeling

Fluid Phase Equilibria, vol. 489, pp. 75-82, 2019

https://dx.doi.org/10.1016/j.fluid.2019.02.010


Bülow M.; Ji X.; Held C.:

Incorporating a concentration-dependent dielectric constant into ePC-SAFT. An application to binary mixtures containing ionic liquids

Fluid Phase Equilibria, vol. 492, pp. 26-33, 2019

https://dx.doi.org/10.1016/j.fluid.2019.03.010


Schleinitz M; Teschner D; Sadowski G; Brandenbusch C:

Second osmotic virial coefficients of therapeutic proteins in the presence of excipient-mixtures can be predicted to aid an efficient formulation design

Journal of Molecular Liquids, vol. 283, pp. 575-583, 2019

https://doi.org/10.1016/j.molliq.2019.03.064