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Interdisciplinary Nanoscience Center

Danish Center for Ultrahigh Field NMR Spectroscopy

Publications

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Nielsen, J. T. & Nielsen, N. C. (2014). VirtualSpectrum, a Tool for Simulating Peak List for Multiple-Dimensional NMR Spectra. Journal of Biomolecular N M R, 60(1), 51-66. https://doi.org/10.1007/s10858-014-9851-1

Nielsen, A. B., Jain, S. K., Ernst, M., Meier, B. H. & Nielsen, N. C. (2013). Adiabatic Rotor-Echo-Short-Pulse-Irradiation Mediated Cross-Polarization. Journal of Magnetic Resonance, 237, 147-151. https://doi.org/10.1016/j.jmr.2013.09.002

Skibsted, J. (2013). Aluminum incorporated in the Calcium Silicate Hydrate (C-S-H) phase studied by solid-state NMR spectroscopy. In D. Stephan, H. V. Daake & G. Land (Eds.), Proceedings of the 1st International Conference on the Chemistry of Construction Materials, 7-9 October 2013, Berlin GDCh Division of Chemistry of Construction Chemicals.

Dai, Z., Tran, T. T. & Skibsted, J. (2013). Aluminum incorporation in the C-S-H phase for white Portland cement – metakaolin – blends studied by 27Al and 29Si MAS NMR. Poster session presented at 1st International Conference on the Chemistry of Construction Materials, Berlin, Germany.

Avanti, C., Oktaviani, N. A., Hinrichs, W. L. J., Frijlink, H. W. & Mulder, F. A. A. (2013). Aspartate buffer and divalent metal ions affect oxytocin in aqueous solution and protect it from degradation. International Journal of Pharmaceutics, 444(1-2), 139-145. https://doi.org/10.1016/j.ijpharm.2013.01.051

Roodbeen, R., Paaske, B., Jiang, L., Jensen, J. K., Christensen, A., Nielsen, J. T., Huang, M., Mulder, F. A. A., Nielsen, N. C., Andreasen, P. & Jensen, K. J. (2013). Bicyclic Peptide Inhibitor of Urokinase-Type Plasminogen Activator: Mode of Action. ChemBioChem, 14(16), 2179–2188. https://doi.org/10.1002/cbic.201300335

Gomez, C. R. S. Q., Fernández-Jiménez, A., Skibsted, J. & Palomo, A. (2013). Clay reactivity: Production of alkali activated cements. Applied Clay Science, 73, 11-16. https://doi.org/10.1016/j.clay.2012.10.012

Zhang, S., Andreasen, M., Nielsen, J. T., Liu, L., Nielsen, E. H., Song, J., Ji, G., Sun, F., Skrydstrup, T., Besenbacher, F., Nielsen, N. C., Otzen, D. E. & Dong, M. (2013). Coexistence of ribbon and helical fibrils originating from hIAPP20-29 revealed by quantitative nanomechanical atomic force microscopy. Proceedings of the National Academy of Sciences (PNAS), 110(8), 2798-2803. https://doi.org/10.1073/pnas.1209955110

Bjerring, M., Jain, S. K., Jensen, B. P., Vinther, J. M. & Nielsen, N. C. (2013). Designing dipolar recoupling and decoupling experiments for biological solid-state NMR using interleaved continuous wave and rf pulse irradiation. Accounts of Chemical Research, 46(9), 2098-2107. https://doi.org/10.1021/ar300329g

Jakobsen, H. J., Bildsøe, H. K., Brorson, M., Gan, Z. & Hung, I. (2013). Direct observation of ¹⁷O-^185/187Re ¹J-coupling in perrhenates by solid-state ¹⁷O VT MAS NMR: Temperature and self-decoupling effects. Journal of Magnetic Resonance, 230, 98-110. https://doi.org/10.1016/j.jmr.2013.01.012

Vinding, M. S., Laustsen, C., Maximov, I., Søgaard, L. V., Ardenkjær-Larsen, J. H. & Nielsen, N. C. (2013). Dynamic nuclear polarization and optimal control spatial-selective 13C MRI and MRS. Journal of Magnetic Resonance, 227, 57-61. https://doi.org/10.1016/j.jmr.2012.12.002

Vinding, M. S., Maximov, I., Tosner, Z. & Nielsen, N. C. (2013). Fast monotonic convergent optimal control algorithm for 2D RF pulses mitigating B0 and B1 inhomogeneities. Poster session presented at ISMRM 2013, Salt Lake City, United States.

Enemark-Rasmussen, K., Tran, T. T. & Skibsted, J. (2013). Fluoride ions as structural probe-ions in ¹⁹F MAS NMR studies of cement materials and thermally activated SCMs. Advances in Cement Research, 26(4), 233-246. https://doi.org/10.1680/adcr.13.00024

Enemark-Rasmussen, K. & Skibsted, J. (2013). Fluoride ions as structural probes-ions in 19F MAS NMR studies of thermally activated SCM’s. Poster session presented at 1st International Conference on the Chemistry of Construction Materials, Berlin, Germany.

Rude, L. H., Filsø, U., D’Anna, V., Spyratou, A., Richter, B., Hino, S., Zavorotynska, O., Baricco, M., Sørby, M. H., Hauback, B. C., Hagemann, H., Besenbacher, F., Skibsted, J. & Jensen, T. R. (2013). Hydrogen–fluorine exchange in NaBH₄–NaBF₄. Physical Chemistry Chemical Physics, 15, 18185-18194. https://doi.org/10.1039/c3cp52815d

Saldan, I., Schulze, M., Pistidda, C., Gosalawit-Utke, R., Zavorotynska, O., Rude, L. H., Skibsted, J., Haase, D., Cerenius, Y., Jensen, T. R., Spoto, G., Baricco, M., Taube, K. & Dornheim, M. (2013). Hydrogen sorption in the LiH-LiF-MgB₂ system. The Journal of Physical Chemistry Part C, 117(33), 17360-17366. https://doi.org/10.1021/jp405856s

Hansen, B. R. S., Jensen, T. R., Skibsted, J. & Ravnsbæk, D. (2013). Hydrogen storage and reversibility in composite systems. Poster session presented at Student conference on Hydrogen and Fuel Cells, København, Denmark.

Hansen, B. R. S., Ravnsbæk, D. B., Reed, D., Book, D., Gundlach, C., Skibsted, J. & Jensen, T. R. (2013). Hydrogen Storage Capacity Loss in a LiBH₄-Al Composite. The Journal of Physical Chemistry Part C, 117(15), 7423-7432. https://doi.org/10.1021/jp312480h

Hansen, B. R. S., Ravnsbæk, D., Skibsted, J., Gundlach, C. & Jensen, T. R. (2013). Hydrogen storage in LiBH4-MgH2-Al. Poster session presented at Gordon Research Conference Hydrogen-Metal Systems, Barga, Italy.

Dai, Z., Tran, T. T. & Skibsted, J. (2013). Incorporation of aluminum in the C-S-H phase for white Portland cement – metakaolin blends studied by 27Al and 29Si MAS NMR spectroscopy. In 33rd Cement and Concrete Science Conference Proceedings University of Portsmouth.

Jepsen, L. H., Skibsted, J. & Jensen, T. R. (2013). Investigations of the thermal decomposition of MBH₄–2NH₃BH₃, M = Na, K. Journal of Alloys and Compounds, 580(1), 287-291. https://doi.org/10.1016/j.jallcom.2013.03.161

Rojek, A., Füchtbauer, E.-M., Füchtbauer, A., Jelen, S., Malmendal, A., Fenton, R. A. & Nielsen, S. (2013). Liver-specific Aquaporin 11 knockout mice show rapid vacuolization of the rough endoplasmic reticulum in periportal hepatocytes after feeding amino acids. American Journal of Physiology: Gastrointestinal and Liver Physiology, 304(5), G501-G515. https://doi.org/10.1152/ajpgi.00208.2012

Jepsen, L., Ban, V., Møller, K. T., Lee, Y.-S., Cho, Y. W., Filinchuk, Y., Skibsted, J. & Jensen, T. R. (2013). M(BH4)2-NH3BH3 (M=Na, K, Mg) for hydrogen storage. Poster session presented at CMC Evaluation Meeting 2013, Aarhus, Denmark.

Jepsen, L. H., Ban, V., Møller, K. T., Lee, Y.-S., Cho, Y. W., Filinchuk, Y., Skibsted, J. & Jensen, T. R. (2013). M(BH4)2-NH3BH3 (M=Na, K, Mg) for hydrogen storage. Poster session presented at Gordon Research Conference Hydrogen-Metal Systems, Barga, Italy.

Kirkegaard, K., Svane, A. S. P., Hindkjær, J. J., Nielsen, N. C. & Ingerslev, H. J. (2013). Metabolic profiles of spent culture media does not predict pregnancy outcome. Abstract from European Society of Human Reproduction and Embryology 29th annual meeting, London, United Kingdom.

Malmendal, A., Sørensen, J. G., Overgaard, J., Holmstrup, M., Nielsen, N. C. & Loeschcke, V. (2013). Metabolomic analysis of the selection response of Drosophila melanogaster to environmental stress: are there links to gene expression and phenotypic traits? Naturwissenschaften, 100, 417–427.

Underhaug, J., Koldsø, H., Runager, K., Nielsen, J. T., Sørensen, C. S., Kristensen, T., Otzen, D., Karring, H., Malmendal, A., Schiøtt, B., Enghild, J. J. & Nielsen, N. C. (2013). Mutation in transforming growth factor beta induced protein associated with granular corneal dystrophy type 1 reduces the proteolytic susceptibility through local structural stabilization. BBA General Subjects, 1834(12), 2812–2822. https://doi.org/10.1016/j.bbapap.2013.10.008

Kehlet, C., Del Federico, E., Schahbaz, H., Catalano, A., Dittmer, J. & Nielsen, N. C. (2013). Non-invasive characterization of polymeric materials in relation to art conservation using unilateral NMR combined with multivariate data analysis. Analytical Methods, 5(17), 4480-4486. https://doi.org/10.1039/c3ay40650d

Laustsen, C., Bowen, S., Vinding, M. S., Nielsen, N. C. & Ardenkjær-Larsen, J. H. (2013). OPTIMAL CONTROL SINGLET STATE STORAGE FOR CLINICAL MR SYSTEMS. Abstract from ISMRM 2013, Salt Lake City, United States.

Wood, K., Gallat, F.-X., Otten, R., van Heel, A. J., Lethier, M., van Eijck, L., Moulin, M., Haertlein, M., Weik, M. & Mulder, F. A. A. (2013). Protein Surface and Core Dynamics Show Concerted Hydration-Dependent Activation. Angewandte Chemie International Edition, 52(2), 665-668. https://doi.org/10.1002/anie.201205898

Hansen, B. R. S., Skibsted, J., Jensen, T. R. & Ravnsbæk, D. (2013). Reversibility in LiBH4-MgH2-Al composite systems. Poster session presented at FCH JU Joint Meeting 2013, Santa Cruz, Spain.

Vinther, J. M., Khaneja, N. & Nielsen, N. C. (2013). Robust and Efficient 19F Heteronuclear Dipolar Decoupling using Refocused Continuous-Wave Rf Irradiation. Journal of Magnetic Resonance. https://doi.org/10.1016/j.jmr.2012.11.003

Garg, N. & Skibsted, J. (2013). Structure and reactivity of a thermally activated montmorillonite by solid-state NMR spectroscopy.. Paper presented at Cement and Concrete Science Conference, Portsmouth, United Kingdom.

Garg, N. & Skibsted, J. (2013). Structure and reactivity of a thermally activated smectitic clay by solid-state NMR. Poster session presented at 1st International Conference on the Chemistry of Construction Materials, Berlin, Germany.

Skibsted, J., Sevelsted, T. F., Poulsen, S. L. & Tran, T. T. (2013). Studies of guest-ion incorporation in Portland cemen - Part 1. ZKG International, 66(4), 66-73.

Skibsted, J., Sevelsted, T. F., Poulsen, S. L. & Tran, T. T. (2013). Studies of guest-ion incorporation in Portland cement - Part 2. ZKG International, 66(6), 46-52.

Sevelsted, T. F., Herfort, D. & Skibsted, J. (2013). ¹³C chemical shift anisotropies for carbonate ions in cement minerals and the use of ¹³C, ²⁷Al and ²⁹Si MAS NMR in studies of Portland cement including limestone additions. Cement and Concrete Research, 52, 100 - 111. https://doi.org/10.1016/j.cemconres.2013.05.010

Pool, T. J., Oktaviani, N. A., Kamikubo, H., Kataoka, M. & Mulder, F. A. A. (2013). ¹H, ¹³C, and ¹⁵N resonance assignment of photoactive yellow protein. Biomolecular N M R Assignments, 7(1), 97-100. https://doi.org/10.1007/s12104-012-9387-9

Hansen, L., Unmack Larsen, E. K., Nielsen, E. H., Iversen, F., Liu, Z., Thomsen, K., Pedersen, M., Skrydstrup, T., Nielsen, N. C., Ploug, M. & Kjems, J. (2013). Targeting of peptide conjugated magnetic nanoparticles to urokinase plasminogen activator receptor (uPAR) expressing cells. Nanoscale, 5, 8192-8201. https://doi.org/10.1039/c3nr32922d

Stöger, B., Weil, M. & Skibsted, J. (2013). The crystal structure of BaPO3F revisited - a combined X-ray diffraction and solid-state F-19, P-31 MAS NMR study. Dalton Transactions (Print Edition), 42, 11672-11582. https://doi.org/10.1039/c3dt50373a

Stöger, B., Weil, M. & Skibsted, J. (2013). The crystal structure of BaPO₃ revisited - a combined X-ray diffraction and solid-state ¹⁹F, ³¹P MAS NMR study. Dalton Transactions (Print Edition), 42(32), 11672-11682. https://doi.org/10.1039/C3DT50373A

Skibsted, J. & Andersen, M. D. (2013). The effect of alkali ions on the incorporation of aluminum in the calcium silicate hydrate (C-S-H) phase resulting from Portland cement hydration studied by ²⁹Si MAS NMR. Journal of the American Ceramic Society, 96(2), 651-656. https://doi.org/10.1111/jace.12024

Kunther, W., Dai, Z., Garzon, S. F., Herfort, J. & Skibsted, J. (2013). Thermodynamic modeling of Portland cement – metakaolin – limestone blends. In D. Stephan, H. V. Daake & G. Land (Eds.), Proceedings of the 1st International Conference on the Chemistry of Construction Materials, 7-9 October 2013, Berlin GDCh Division of Chemistry of Construction Chemicals.

Skibsted, J., Sevelsted, T. F., Poulsen, S. L. & Tran, T. T. (2013). Untersuchung von Gast-Ionen-Aufnahme in Portlandzement - Teil 1. ZKG International, 66(4), 66-73.

Skibsted, J., Sevelsted, T. F., Poulsen, S. L. & Tran, T. T. (2013). Untersuchung von Gast-Ionen-Aufnahme in Portlandzement - Teil 2. ZKG International, 66(6), 46-52.

Nielsen, S. B., Macchi, F., Raccosta, S., Langkilde, A. E., Giehm, L., Kyrsting, A., Svane, A. S. P., Manno, M., Christiansen, G., Nielsen, N. C., Oddershede, L., Vestergaard, B. & Otzen, D. (2013). Wildtype and A30P Mutant Alpha-Synuclein Form Different Fibril Structures. PLoS One, 8(7), Article e67713. https://doi.org/10.1371/journal.pone.0067713

Gosalawit-Utke, R., Nielsen, T. K., Pranzas, K., Saldan, I., Pistidda, C., Karimi, F., Laipple, D., Skibsted, J., Jensen, T. R., Klassen, T. & Dornheim, M. (2012). 2LiBH₄–MgH₂ in a Resorcinol–Furfural Carbon Aerogel Scaffold for Reversible Hydrogen Storage. The Journal of Physical Chemistry Part C, 116(1), 1526-1534. https://doi.org/10.1021/jp2088127

Larsen, E. K. U., Nielsen, T., Wittenborn, T., Rydtoft, L. M., Lokanathan, A. R., Hansen, L., Østergaard, L., Kingshott, P., Howard, K. A., Besenbacher, F., Nielsen, N. C. & Kjems, J. (2012). Accumulation of magnetic iron oxide nanoparticles coated with variably sized polyethylene glycol in murine tumors. Nanoscale, 4(7), 2352-2361 . https://doi.org/10.1039/C2NR11554A

Loening, N. M., Bjerring, M., Nielsen, N. C. & Oschkinat, H. (2012). A comparison of NCO and NCA transfer methods for biological solid-state NMR spectroscopy. Journal of Magnetic Resonance, 214, 81-90. https://doi.org/10.1016/j.jmr.2011.10.012

Ruiz-Santaquiteria, C., Skibsted, J., Fernández-Jiménez, A. & Palomo, A. (2012). Alkaline solution/binder ratio as a determining factor in the alkaline activation of aluminosilicates. Cement and Concrete Research, 42(9), 1242-1251. https://doi.org/10.1016/j.cemconres.2012.05.019

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Revised 17.04.2023

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Lise Refstrup Linnebjerg Pedersen