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Interdisciplinary Nanoscience Center

Danish Center for Ultrahigh Field NMR Spectroscopy

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Cheng, S., Yang, G., Zhao, Y., Peng, M., Skibsted, J. & Yue, Y. (2015). Quantification of the boron speciation in alkali borosilicate glasses by electron energy loss spectroscopy. Scientific Reports, 5, [17526]. https://doi.org/10.1038/srep17526

Gomez, C. R. S. Q. & Skibsted, J. (2015). Reactivity of heated kaolinite from a combination of chemical methods and solid-state NMR spectroscopy. In ICCC 2015 Beijing : the 14th international congress on the chemistry of cement, 13-16 October, 2015 (pp. 310)

Gomez, C. R. S. Q. & Skibsted, J. (2015). Reactivity of heated kaolinite from a combination of solid-state NMR and chemical methods. In K. Scrivener & A. Favier (Eds.), Calcined Clays for Sustainable Concrete: Proceedings of the 1st International Conference on Calcined Clays for Sustainable Concrete (pp. 125-132). Springer. RILEM Bookseries Vol. 10 https://doi.org/10.1007/978-94-017-9939-3_16

Maximov, I. I., Vinding, M. S., Tse, D. H. Y., Nielsen, N. C. & Shah, N. J. (2015). Real-time 2D spatially selective MRI experiments: Comparative analysis of optimal control design methods. Journal of Magnetic Resonance, 254(110-120), 110-120. https://doi.org/10.1016/j.jmr.2015.03.003

Supur, M., Yurtsever, A. & Akbey, Ü. (2015). Remarkable enhancement of ambient-air electrical conductivity of the perylenediimide π-stacks isolated in the flexible films of a hydrogen-bonded polymer. RSC Advances, 5(79), 64240-64246. https://doi.org/10.1039/c5ra12169h

Ma, P., Deshmukh, Y. S., Wilsens, C. H. R. M., Hansen, M. R., Graf, R. & Rastogi, S. (2015). Self-assembling process of Oxalamide compounds and their nucleation efficiency in bio-degradable Poly(hydroxyalkanoate)s. Scientific Reports, 5, [13280]. https://doi.org/10.1038/srep13280

Nieuwkoop, A. J., Franks, W. T., Rehbein, K., Diehl, A., Akbey, U., Engelke, F., Emsley, L., Pintacuda, G. & Oschkinat, H. (2015). Sensitivity and resolution of proton detected spectra of a deuterated protein at 40 and 60 kHz magic-angle-spinning. Journal of Biomolecular N M R, 61(2), 161-171. https://doi.org/10.1007/s10858-015-9904-0

Hansen, S. K., Bertelsen, K., Jensen, B. P., Nielsen, N. C. & Vosegaard, T. (2015). Solid-State NMR Methods for Oriented Membrane Proteins. Progress in Nuclear Magnetic Resonance Spectroscopy, 88-89, 48-85. https://doi.org/10.1016/j.pnmrs.2015.05.001

Olesen, H. G., Mohr, D., Seweryn, P., Yoshimura, Y., Kutlubaeva, Z., Dolman, F., Chelchessa, B., Chetverin, A. B., Mulder, F. A. A., Brodersen, D. E. & Knudsen, C. R. (2015). Structural basis for RNA-genome recognition during bacteriophage Qβ replication. Nucleic Acids Research, 43(22), 10893-10906. https://doi.org/10.1093/nar/gkv1212

Jensen, S., Jepsen, L., Skibsted, J. & Jensen, T. R. (2015). Study of the NaBH₄/KBH₄ system with thermal treatment and in-situ PXD. Poster session presented at Danscatt Annual meeting 2015, Aarhus, Denmark.

Etzold, F., Howard, I. A., Forler, N., Melnyk, A., Andrienko, D., Hansen, M. R. & Laquai, F. (2015). Sub-ns triplet state formation by non-geminate recombination in PSBTBT:PC70BM and PCPDTBT:PC60BM organic solar cells. Energy & Environmental Science, 8(5), 1511-1522. https://doi.org/10.1039/c4ee03630a

Jasinska-Walc, L., Bouyahyi, M., Rozanski, A., Graf, R., Hansen, M. R. & Duchateau, R. (2015). Synthetic Principles Determining Local Organization of Copolyesters Prepared from Lactones and Macrolactones. Macromolecules, 48(3), 502-510. https://doi.org/10.1021/ma502262e

Scrivener, K. L., Lothenbach, B., De Belie, N., Gruyaert, E., Skibsted, J., Snellings, R. & Vollpracht, A. (2015). TC 238-SCM: hydration and microstructure of concrete with SCMs: State of the art on methods to determine degree of reaction of SCMs. Materials and Structures, 48(4), 835-862. https://doi.org/10.1617/s11527-015-0527-4

Frahm, H., Hansen, S. K., Vad, B. S., Nielsen, E. H., Nielsen, J. T., Vosegaard, T., Skrydstrup, T. & Otzen, D. E. (2015). The natural, peptaibolic peptide SPF-5506-A4 adopts a β-bend spiral structure, shows low hemolytic activity and targets membranes through formation of large pores. B B A - Proteins and Proteomics, 1854(8), 882-889. https://doi.org/10.1016/j.bbapap.2015.03.003

Hong, Z., Nowakowski, M., Spronk, C., Petersen, S. V., Andreasen, P., Koźmiński, W., Mulder, F. & Jensen, J. K. (2015). The solution structure of the MANEC-type domain from Hepatocyte Growth Factor Activator Inhibitor 1 reveals an unexpected PAN/apple domain-type fold. Biochemical Journal, 466(2), 299-309. https://doi.org/10.1042/BJ20141236

Mentink-Vigier, F., Akbey, Ü., Oschkinat, H., Vega, S. & Feintuch, A. (2015). Theoretical aspects of Magic Angle Spinning - Dynamic Nuclear Polarization. Journal of Magnetic Resonance, 258, 102-120. https://doi.org/10.1016/j.jmr.2015.07.001

Skibsted, J., Dai, Z., Enemark-Rasmussen, K. & Garg, N. (2015). Thermal activation and pozzolanic reactivity of calcined clay minerals for applications in Portland cement blends. In 19th IBAUSIL – Internationale Baustofftagung (pp. 191-204). Bauhaus-Universität Weimar.

Kunther, W., Dai, Z. & Skibsted, J. (2015). Thermodynamic modeling of Portland cement - metakaolin - limestone blends. In K. Scrivener & A. Favier (Eds.), Calcined clays for sustainable concrete: Proceedings of the 1st International Conference on Calcined Clays for Sustainable Concrete (pp. 143-149). Springer. RILEM Bookseries Vol. 10 https://doi.org/10.1007/978-94-017-9939-3_18

Kunther, W., Dai, Z. & Skibsted, J. (2015). Thermodynamic modeling of Portland cement – metakaolin – limestone blends. In ICCC 2015 Beijing : the 14th international congress on the chemistry of cement, 13-16 October, 2015: 1 Abstract book (pp. 108-114)

Wroblewska, A., Zych, A., Thiyagarajan, S., Dudenko, D., van Es, D., Hansen, M. R., Koning, C., Duchateau, R. & Jasinska-Walc, L. (2015). Towards sugar-derived polyamides as environmentally friendly materials. Polymer Chemistry, 6(22), 4133-4143. https://doi.org/10.1039/c5py00521c

Jepsen, L. H., Ley, M. B., Černý, R., Lee, Y-S., Cho, Y. W., Ravnsbæk, D., Besenbacher, F., Skibsted, J. & Jensen, T. R. (2015). Trends in Syntheses, Structures, and Properties for Three Series of Ammine Rare-Earth Metal Borohydrides, M(BH₄)₃·nNH₃ (M = Y, Gd, and Dy). Inorganic Chemistry, 54(15), 7402-7414. https://doi.org/10.1021/acs.inorgchem.5b00951

Vosegaard, T. (2015). jsNMR: An Embedded Platform-Independent NMR Spectrum Viewer. Magnetic Resonance in Chemistry, 53(4), 285-290. https://doi.org/10.1002/mrc.4195

Nørby, P., Overgaard, J., Sigaard Christensen, P., Richter, B., Song, X., Dong, MD., Han, A., Skibsted, J., Iversen, B. B. & Johnsen, S. (2014). (NH₄)₄Sn₂S₆·3H ₂O: Crystal structure, thermal decomposition, and precursor for textured thin film. Chemistry of Materials, 26(15), 4494-4504. https://doi.org/10.1021/cm501681r

Gosalawit-Utke, R., Milanese, C., Javadian, P., Girella, A., Laipple, D., Puszkiel, J., Cattaneo, A. S., Ferrara, C., Wittayakhun, J., Skibsted, J., Jensen, T. R., Marini, A., Klassen, T. & Dornheim, M. (2014). 2LiBH₄-MgH₂-0.13TiCl₄ confined in nanoporous structure of carbon aerogel scaffold for reversible hydrogen storage. Journal of Alloys and Compounds, 599, 78-86. https://doi.org/10.1016/j.jallcom.2014.02.032

Miloskovska, E., Hansen, M. R., Friedrich, C., Hristova-Bogaerds, D., Van Duin, M. & De With, G. (2014). In Situ Silica Nanoparticle Formation in a Rubber Matrix Monitored via Real-Time SAXS and Solid-State NMR Spectroscopy. Macromolecules, 47(15), 5174-5185. https://doi.org/10.1021/ma500594a

Lendel, C., Bjerring, M., Dubnovitsky, A., Kelly, R., Filippov, A., Antzutkin, O. N., Nielsen, N. C. & Härd, T. (2014). A Hexameric Peptide Barrel as Building Block of Amyloid-beta Protofibrils. Angewandte Chemie International Edition, 53(47), 12756-12760. https://doi.org/10.1002/anie.201406357

Zhao, B., Xu, P., Jiang, L., Paaske, B., Kromann-Hansen, T., Jensen, J. K., Sørensen, H. P., Liu, Z., Nielsen, J. T., Christensen, A., Hosseini, M., Sørensen, K. K., Nielsen, N. C., Jensen, K. J., Huang, M. & Andreasen, P. A. (2014). A cyclic peptidic serine protease inhibitor: increasing affinity by increasing Peptide flexibility. PLOS ONE, 9(12), [e115872]. https://doi.org/10.1371/journal.pone.0115872

Jepsen, L. H., Ravnsbæk, D. B., Grundlach, C., Besenbacher, F., Skibsted, J. & Jensen, T. R. (2014). A novel intermediate in the LiAlH₄-LiNH₂ hydrogen storage system. Dalton Transactions (Print Edition), 43(8), 3095-3103. https://doi.org/10.1039/c3dt52538d

Nørnberg, P., Jensen, S. K., Skibsted, J., Jakobsen, H. J., Kate, I. L. T., Gunnlaugsson, H. P., Merrison, J. P., Finster, K., Bak, E. N., Iversen, J. J. & Kondrup, J. C. (2014). A possible sink for methane on Mars. http://www.hou.usra.edu/meetings/8thmars2014/pdf/1111.pdf

Jensen, S. K., Skibsted, J., Jakobsen, H. J., Kate, I. L. T., Gunnlaugsson, H. P., Merrison, J. P., Finster, K., Bak, E. N., Iversen, J. J., Kondrup, J. C. & Nørnberg, P. (2014). A sink for methane on Mars? The answer is blowing in the wind. Icarus, 236, 24-27. https://doi.org/10.1016/j.icarus.2014.03.036

Wittenborn, T. R., Larsen, E. K. U., Nielsen, T., Rydtoft, L. M., Hansen, L., Nygaard, J. V., Vorup-Jensen, T., Kjems, J., Horsman, M. R. & Nielsen, N. C. (2014). Accumulation of nano-sized particles in a murine model of angiogenesis. Biochemical and Biophysical Research Communications, 443(2), 470-6. https://doi.org/10.1016/j.bbrc.2013.11.127

Straasø, L. A., Nielsen, J. T., Bjerring, M., Khaneja, N. & Nielsen, N. C. (2014). Accurate measurements of ¹³C-¹³C distances in uniformly ¹³C-labeled proteins using multi-dimensional four-oscillating field solid-state NMR spectroscopy. Journal of Chemical Physics, 141(11), [114201]. https://doi.org/10.1063/1.4895527

Graf, R., Hansen, M. R., Hinderberger, D., Muennemann, K. & Spiess, H. W. (2014). Advanced magnetic resonance strategies for the elucidation of nanostructured soft matter. Physical Chemistry Chemical Physics, 16(21), 9700-9712. https://doi.org/10.1039/c3cp54614d

Dai, Z., Tran, T. T. & Skibsted, J. (2014). Aluminum Incorporation in the C-S-H Phase of White Portland Cement-Metakaolin Blends studied by ²⁷Al and ²⁹Si MAS NMR Spectroscopy. Journal of the American Ceramic Society, 97(8), 2662-2671. https://doi.org/10.1111/jace.13006

Nielsen, J. T., Kulminskaya, N., Bjerring, M. & Nielsen, N. C. (2014). Automated robust and accurate assignment of protein resonances for solid state NMR. Journal of Biomolecular N M R, 59(2), 119-134. https://doi.org/10.1007/s10858-014-9835-1

O'Malley, T. T., Oktaviani, N. A., Zhang, D., Lomakin, A., O'Nuallain, B., Linse, S., Benedek, G. B., Rowan, M. J., Mulder, F. A. A. & Walsh, D. M. (2014). Aβ dimers differ from monomers in structural propensity, aggregation paths and population of synaptotoxic assemblies. Biochemical Journal, 461(3), 413-426. https://doi.org/10.1042/BJ20140219

Narita, A., Verzhbitskiy, I. A., Frederickx, W., Mali, K. S., Jensen, S. A., Hansen, M. R., Bonn, M., De Feyter, S., Casiraghi, C., Feng, X. & Müllen, K. (2014). Bottom-Up Synthesis of Liquid-Phase-Processable Graphene Nanoribbons with Near-Infrared Absorption. ACS Nano, 8(11), 11622-11630. https://doi.org/10.1021/nn5049014

Tosner, Z., Andersen, R., Stevensson, B., Edén, M., Nielsen, N. C. & Vosegaard, T. (2014). Computer-intensive simulation of solid-state NMR experiments using SIMPSON. Journal of Magnetic Resonance, 246, 79-93. https://doi.org/10.1016/j.jmr.2014.07.002

Vinding, M. S., Guérin, B. & Nielsen, N. C. (2014). Constraining local and global SAR in MRI pulse design. Poster session presented at 35th Danish NMR Meeting, Denmark.

Pistidda, C., Karimi, F., Garroni, S., Rzeszutek, A., Bonatto Minella, C., Milanese, C., Le, T. T., Rude, L. H., Skibsted, J., Jensen, T. R., Horstmann, C., Gundlach, C., Tolkiehn, M., Pranzas, P. K., Schreyer, A., Klassen, T. & Dornheim, M. (2014). Effect of the Partial Replacement of CaH₂ with CaF₂ in the Mixed System CaH₂ + MgB₂. The Journal of Physical Chemistry Part C, 118(49), 28409-28417. https://doi.org/10.1021/jp508780b

Equbal, A., Paul, S., Mithu, V. S., Madhu, P. K. & Nielsen, N. C. (2014). Efficient Heteronuclear Decoupling in MAS Solid-State NMR using Non-rotor-synchronized rCW Irradiation. Journal of Magnetic Resonance, 246, 104-109. https://doi.org/10.1016/j.jmr.2014.07.006

Basse, K., Jain, S. K., Bakharev, O. N. & Nielsen, N. C. (2014). Efficient Polarization Transfer between Spin-1/2 and ¹⁴N Nuclei in Solid-State MAS NMR Spectroscopy. Journal of Magnetic Resonance, 244, 85-89. https://doi.org/10.1016/j.jmr.2014.04.017

Bjerring, M. & Nielsen, N. C. (2014). Forskningscenter: inSPIN Center for Insoluble Protein Structures. Biozoom, 2014(2), 1-9. http://www.biokemi.org/biozoom/issues/534/articles/2453

Lovschall, H., Ranjkesh, B., Illemann, K., Birn, L. B. & Skibsted, J. (2014). Gillmore testing of initial setting-time: iMTA, Dycal Biodentine and MTA.

El Gemayel, M., Narita, A., Dössel, L. F., Sundaram, R. S., Kiersnowski, A., Pisula, W., Hansen, M. R., Ferrari, A. C., Orgiu, E., Feng, X., Müllen, K. & Samorì, P. (2014). Graphene nanoribbon blends with P3HT for organic electronics. Nanoscale, 6(12), 6301-6314. https://doi.org/10.1039/c4nr00256c

Lorenzen, N., Nielsen, S. B., Yoshimura, Y., Vad, B. S., Andersen, C. B., Betzer, C., Kaspersen, J. D., Christiansen, G., Pedersen, J. S., Jensen, P. H., Mulder, F. A. A. & Otzen, D. E. (2014). How epigallocatechin gallate can inhibit α-synuclein oligomer toxicity in vitro. Journal of Biological Chemistry, 289(31), 21299-21310. https://doi.org/10.1074/jbc.M114.554667

Penner, R., Andersen, E. S., Jensen, J. L., Kantcheva, A. K., Bublitz, M., Nissen, P., Rasmussen, A. M. H., Svane, K. L., Hammer, B., Rezazadegan, R., Nielsen, N. C., Nielsen, J. T. & Andersen, J. E. (2014). Hydrogen bond rotations as a uniform structural tool for analyzing protein architecture. Nature Communications, 5, [5803]. https://doi.org/10.1038/ncomms6803

Hansen, B. R. S., Bomholdt Ravnsbæk, D., Skibsted, J. & Jensen, T. R. (2014). Hydrogen reversibility of LiBH₄-MgH₂-Al composites. Physical Chemistry Chemical Physics, 16(19), 8970-8980. https://doi.org/10.1039/c4cp00651h

Hansen, S. K., Vestergaard, M., Thøgersen, L., Schiøtt, B., Nielsen, N. C. & Vosegaard, T. (2014). Lipid Dynamics Studied by Calculation of 31P Solid-State NMR Spectra Using Ensembles from Molecular Dynamics Simulations. Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical, 118(19), 5119-5129. https://doi.org/10.1021/jp5000304

Jakobsen, H. J., Bildsoe, H., Beekman, M., Stefanoski, S., Nolas, G. S. & Bowers, C. R. (2014). Low-Temperature ²³Na MAS NMR Reveals Dynamic Effects and Compositions for the Large and Small Channels in the Zeolite-Like Ge-Framework of Na_1-xGe_3+Z Materials. The Journal of Physical Chemistry Part C, 118(49), 28890-28897. https://doi.org/10.1021/jp509978j

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Lise Refstrup Linnebjerg Pedersen