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PoreMS : a software tool for generating silica pore models with user-defined surface functionalisation and pore dimensions

, , , , , and . Molecular simulation, 47 (4): 306-316 (2021)
DOI: 10.1080/08927022.2020.1871478

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Supplementary material for 'Computational study of confinement effects in molecular heterogeneous catalysis', , and . Dataset, (2022)Related to: Kraus H., Rybka J., Tallarek U., Hansen N. (2021) Computational Study of Confinement Effects in Molecular Heterogeneous Catalysis. In: Nagel W.E., Kröner D.H., Resch M.M. (eds) High Performance Computing in Science and Engineering '20. Springer, Cham. doi: 10.1007/978-3-030-80602-6_7.Olefin Metathesis in Confined Geometries : A Biomimetic Approach toward Selective Macrocyclization, , , , , , , , , and . Journal of the American Chemical Society, 141 (48): 19014-19022 (2019)PoreMS : a software tool for generating silica pore models with user-defined surface functionalisation and pore dimensions, , , , , and . Molecular simulation, 47 (4): 306-316 (2021)Supplementary material for 'Olefin metathesis in confined geometries: a biomimetic approach towards selective macrocyclization', and . Dataset, (2019)Related to: Ziegler, Felix; Teske, Johannes; Elser, Iris; Dyballa, Michael; Frey, Wolfgang; Kraus, Hamzeh; Hansen, Niels; Rybka, Julia; Tallarek, Ulrich; Buchmeiser, Michael R (2019): Olefin Metathesis in Confined Geometries: A Biomimetic Approach toward Selective Macrocyclization. In: Journal of the American Chemical Society. doi: 10.1021/jacs.9b08776.Olefin Metathesis in Confined Geometries: A Biomimetic Approach Towards Selective Macrocyclization, , , , , , , , , and . Journal of the American Chemical Society, (November 2019)