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de Zwart, F. J., Reus, B., Laporte, A. A. H., Sinha, V., & de Bruin, B. (2021). Metrical Oxidation States of 1,4-Diazadiene-Derived Ligands. Inorganic Chemistry, 60(5), 3274-3281. https://doi.org/10.1021/acs.inorgchem.0c03685 -
Baij, L., Liu, C., Buijs, J., Alvarez Martin, A., Westert, D., Raven, L., Geels, N., Noble, P., Sprakel, J., & Keune, K. (2021). Understanding and optimizing-Evolon (R) CR for varnish removal from oil paintings. Heritage Science, 9, Article 155. https://doi.org/10.1186/s40494-021-00627-9 -
Cremer, C., Goswami, M., Rank, C. K., de Bruin, B., & Patureau, F. W. (2021). Tellurium(II)/Tellurium(III)-Catalyzed Cross-Dehydrogenative C-N Bond Formation. Angewandte Chemie, International Edition, 60(12), 6451-6456. https://doi.org/10.1002/anie.202015248, https://doi.org/10.1002/ange.202015248 -
Li, Y.-Y., Meijer, E. J., & Liao, R.-Z. (2021). Elucidating the Role of Aqueous Solvent in an Iron-Based Water Oxidation System by DFT-based Molecular Simulation. ChemCatChem, 13(19), 4251-4259. https://doi.org/10.1002/cctc.202100616 -
Timmer, B. J. J., Kooijman, A., Schaapkens, X., & Mooibroek, T. J. (2021). A Synthetic Galectin Mimic. Angewandte Chemie, International Edition, 60(29), 16178-16183. https://doi.org/10.1002/anie.202104924, https://doi.org/10.1002/ange.202104924 -
den Uijl, M. J., Schoenmakers, P. J., Pirok, B. W. J., & van Bommel, M. R. (2021). Recent applications of retention modelling in liquid chromatography. Journal of Separation Science, 44(1), 88-114. https://doi.org/10.1002/jssc.202000905 -
Frassek, M., Arjun, A., & Bolhuis, P. G. (2021). An extended autoencoder model for reaction coordinate discovery in rare event molecular dynamics datasets. Journal of Chemical Physics, 155(6), Article 064103. https://doi.org/10.1063/5.0058639 -
Iedema, P. D., Remerie, K., Seegers, D., & McAuley, K. B. (2021). Tacticity Changes during Controlled Degradation of Polypropylene. Macromolecules, 54(19), 8921-8935. https://doi.org/10.1021/acs.macromol.1c01383 -
Stieffenhofer, M., Bereau, T., & Wand, M. (2021). Adversarial reverse mapping of condensed-phase molecular structures: Chemical transferability. APL Materials, 9(3), Article 031107. https://doi.org/10.1063/5.0039102
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