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Torres-Knoop, A., Poursaeidesfahani, A., Vlugt, T. J. H., & Dubbeldam, D. (2017). Behavior of the Enthalpy of Adsorption in Nanoporous Materials Close to Saturation Conditions. Journal of Chemical Theory and Computation, 13(7), 3326-3339. https://doi.org/10.1021/acs.jctc.6b01193
Brotzakis, Z. F. (2017). Hydration layer dynamics and association mechanisms of food and antifreeze proteins: A Molecular Dynamics and Transition Path Sampling study. [Thesis, fully internal, Universiteit van Amsterdam].
Cabriolu, R., Refsnes, K. M. S., Bolhuis, P. G., & van Erp, T. S. (2017). Foundations and latest advances in replica exchange transition interface sampling. Journal of Chemical Physics, 147(15), Article 152722. https://doi.org/10.1063/1.4989844
Vijaykumar, A., ten Wolde, P. R., & Bolhuis, P. G. (2017). The magnitude of the intrinsic rate constant: How deep can association reactions be in the diffusion limited regime? Journal of Chemical Physics, 147(18), Article 184108. https://doi.org/10.1063/1.5009547
Newton, A. C. (2017). Self-assembly via anisotropic interactions: Modeling association kinetics of patchy particle systems and self-assembly induced by critical Casimir forces. [Thesis, fully internal, Universiteit van Amsterdam].
Hermans, J. J. (2017). Metal soaps in oil paint: Structure, mechanisms and dynamics. [Thesis, fully internal, Universiteit van Amsterdam].
Krishna, R. (2017). Highlighting multiplicity in the Gilliland solution to the Maxwell-Stefan equations describing diffusion distillation. Chemical Engineering Science, 164, 63-70. https://doi.org/10.1016/j.ces.2017.01.060
Liu, L., Lukose, B., & Ensing, B. (2017). Hydrogen Activation by Frustrated Lewis Pairs Revisited by Metadynamics Simulations. The Journal of Physical Chemistry. C, 121(4), 2046-2051. https://doi.org/10.1021/acs.jpcc.6b09991
Krishna, R., Hijikata, Y., Sato, H., Sato, Y., Matsuda, R., Takata, M., Horike, S., Foo, M. L., Duan, J., Kitagawa, S., Hori, A., & Kubota, Y. (2016). CCDC 1008212: Experimental Crystal Structure Determination [Data set]. The Cambridge Structural Database. https://doi.org/10.5517/ccdc.csd.cc12v3z0
Horike, S., Sato, H., Duan, J., Takata, M., Sato, Y., Kitagawa, S., Kubota, Y., Hijikata, Y., Krishna, R., Foo, M. L., Hori, A., & Matsuda, R. (2016). CCDC 1008213: Experimental Crystal Structure Determination [Data set]. The Cambridge Structural Database. https://doi.org/10.5517/ccdc.csd.cc12v402

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