Interdisciplinary Nanoscience Center

Danish Center for Ultrahigh Field NMR Spectroscopy

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Publications

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Nielsen, J. T. & Mulder, F. A. A. (2016). There is Diversity in Disorder-"In all Chaos there is a Cosmos, in all Disorder a Secret Order". Frontiers in Molecular Biosciences, 3(FEB), Article 4. https://doi.org/10.3389/fmolb.2016.00004
Andersen, O. J., Risør, M. W., Poulsen, E. C., Nielsen, N. C., Miao, Y., Enghild, J. J. & Schiøtt, B. (2017). The reactive center loop insertion in α-1-antitrypsin captured by accelerated molecular dynamics simulation. Biochemistry, 56(4), 634-646. https://doi.org/10.1021/acs.biochem.6b00839
Vu-Quang, H., Vinding, M. S., Nielsen, T., Ullisch, M. G., Nielsen, N. C. & Kjems, J. (2016). Theranostic Tumor Targeted Nanoparticles Combining Drug Delivery with Dual Near Infrared and (19)F Magnetic Resonance Imaging Modalities. Nanomedicine: Nanotechnology, Biology and Medicine, 12(7), 1873-1884. https://doi.org/10.1016/j.nano.2016.04.010
Yang, C., Vu Quang, H., Husum, D. M. U., Tingskov, S. J. H., Vinding, M. S., Nielsen, T., Song, P., Nielsen, N. C., Nørregaard, R. & Kjems, J. (2017). Theranostic poly(lactic-co-glycolic acid) nanoparticle for magnetic resonance/infrared fluorescence bimodal imaging and efficient siRNA delivery to macrophages and its evaluation in a kidney injury model. Nanomedicine: Nanotechnology, Biology and Medicine, 13(8), 2451–2462. https://doi.org/10.1016/j.nano.2017.08.007
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
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. Biochimica et Biophysica Acta - Proteins and Proteomics, 1854(8), 882-889. https://doi.org/10.1016/j.bbapap.2015.03.003
Fruergaard, S., Lund, M. B., Schramm, A., Vosegaard, T. & Bilde, T. (2021). The myth of antibiotic spider silk. iScience, 24(10), Article 103125. https://doi.org/10.1016/j.isci.2021.103125
Sarup, P. M., Pedersen, S. M., Nielsen, N. C., Malmendal, A. & Loeschcke, V. (2012). The metabolic profile of long-lived Drosophila melanogaster. PLoS One, 7(10), e47461. https://doi.org/10.1371/journal.pone.0047461
Petersen, S. V., Kristensen, T., Petersen, J. S., Ramsgaard, L., Oury, T. D., Crapo, J. D., Nielsen, N. C. & Enghild, J. J. (2008). The folding of human aEC-sod and iEC-sod is an intracellular event. Journal of Biological Chemistry.
Petersen, S. V., Kristensen, T., Petersen, J. S., Ramsgaard, L., Oury, T., Crapo, J., Nielsen, N. C. & Enghild, J. J. (2008). The folding of human active and inactive extracellular superoxide dismutase is an intracellular event. Journal of Biological Chemistry, 283(22), 15031. https://doi.org/10.1074/jbc.M801548200
Vosegaard, T., Malmendal, A. & Nielsen, N. C. (2002). The flexibility of SIMPSON and SIMMOL for numerical simulations in solid- and liquid-state NMR spectroscopy. Chem. Monthly, 133, 1555-1574.
Grinderslev, J. B., Skibsted, J. & Jensen, T. R. (2025). The Effects of Nanoconfinement in LiBH4·1/2CH3NH2-Al2O3 Composites. ACS Applied Energy Materials, 8(1), 298-305. https://doi.org/10.1021/acsaem.4c02360
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
Drits, V. A., Lindgreen, H., Sakharov, B. A., Jakobsen, H. J. & Zviagina, B. B. (2004). The detailed structure and origin of clay minerals at the Cretaceous/Tertiary boundary, Stevns Klint (Denmark). Clay Minerals, 39, 367-390.
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 , 42(32), 11672-11682. https://doi.org/10.1039/C3DT50373A
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 , 42, 11672-11582. https://doi.org/10.1039/c3dt50373a
Dass, R., Corlianò, E. & Mulder, F. A. A. (2021). The contribution of electrostatics to hydrogen exchange in the unfolded protein state. Biophysical Journal, 120(18), 4107-4114. https://doi.org/10.1016/j.bpj.2021.08.003
Petersen, S. V., Thøgersen, I., Valnickova, Z., Nielsen, M. S., Petersen, J. S., Poulsen, E. T., Jacobsen, C., Oury, T. D., Moestrup, S. K., Crapo, J. D., Nielsen, N. C., Kristensen, T. & Enghild, J. J. (2010). The concentration of extracellular superoxide dismutase in plasma is maintained by LRP-mediated endocytosis. Free Radical Biology & Medicine, 49(5), 894-9. https://doi.org/10.1016/j.freeradbiomed.2010.06.019
Nielsen, U. G., Topsøe, N.-Y., Brorson, M., Skibsted, J. & Jakobsen, H. J. (2004). The Complete 51V MAS NMR Spectrum of Surface Vanadia Nanoparticles on Anatase (TiO2): Vanadia Surface Structure of a DeNOx Catalysts. Journal of the American Chemical Society, 126(15), 4926-4933.
Thomsen, R. M., Skibsted, J. & Yue, Y. (2018). The Charge-Balancing Role of Calcium and Alkali Ions in Per-Alkaline Aluminosilicate Glasses. Journal of Physical Chemistry B, 122(12), 3184-3195. https://doi.org/10.1021/acs.jpcb.7b12437
Jiang, L., Svane, A. S. P., Sørensen, H. P., Jensen, J. K., Hosseini, M., Chen, Z., Weydert, C., Nielsen, J. T., Christensen, A., Yuan, C., Jensen, K. J., Nielsen, N. C., Malmendal, A., Huang, M. & Andreasen, P. (2011). The binding mechanism of a peptidic cyclic serine protease inhibitor. International Journal of Molecular Biology, 412(2), 235-50. https://doi.org/10.1016/j.jmb.2011.07.028
Risør, M. W., Poulsen, E. T., Thomsen, L. R., Dyrlund, T. F., Nielsen, T. A., Nielsen, N. C., Sanggaard, K. W. & Enghild, J. J. (2014). The autolysis of human HtrA1 is governed by the redox state of its N-terminal domain. Biochemistry, 53(23), 3851-3857. https://doi.org/10.1021/bi401633w
Hjørringgaard, C. U., Nielsen, N. C., Pedersen, J. M. & Skrydstrup, T. (2007). Templated Multimers of Antimicrobial Peptides. Poster session presented at iNANO Autumn School, Fuglsø Centret, Denmark.
Hjørringgaard, C. U., Vad, B. S., Nielsen, S. B., Nielsen, N. C., Otzen, D. & Skrydstrup, T. (2009). Templated Multimers of Antimicrobial Peptides. Poster session presented at 8th Australian Peptide Conference, Peptides - Tools, Targets & Therapeutics , Australia.
Geiger, M.-A., Orwick-Rydmark, M., Märker, K., Franks, W. T., Akhmetzyanov, D., Stöppler, D., Zinke, M., Specker, E., Nazaré, M., Diehl, A., van Rossum, B.-J., Aussenac, F., Prisner, T., Akbey, Ü. & Oschkinat, H. (2016). Temperature dependence of cross-effect dynamic nuclear polarization in rotating solids: advantages of elevated temperatures. Physical Chemistry Chemical Physics, 18, 30696-30704. https://doi.org/10.1039/c6cp06154k
Nielsen, N. C., Malmendal, A. & Vosegaard, T. (2004). Techniques and Applications of NMR to Membrane Proteins. Mol. Membr. Biol., 21, 129-141.
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
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
Nielsen, N. C. & Hohwy, M. (1998). Systematic design and evaluation of multiple-pulse experiments in nuclearmagnetic resonance spectroscopy using a semi-continuous Baker-Campbell-Hausdorff expansion. Journal of Chemical Physics, 109, 3780-3791.
Payandeh GharibDoust, S., Brighi, M., Sadikin, Y., Ravnsbæk, D., Cerný, R., Skibsted, J. & Jensen, T. R. (2017). Synthesis, Structure, and Li-Ion Conductivity of LiLa(BH4)3X, X = Cl, Br, I. Journal of Physical Chemistry C, 121(35), 19010-19021. https://doi.org/10.1021/acs.jpcc.7b04905
Molino, A., Holzinger, J., Lukaszuk, K. A., Rojo-Gama, D., Gunnaes, A. E., Skibsted, J., Lundegaard, L. F., Svelle, S., Beato, P., Bordiga, S. & Lillerud, K. P. (2019). Synthesis of ZSM-23 (MTT) zeolites with different crystal morphology and intergrowths: effects on the catalytic performance in the conversion of methanol to hydrocarbons. Catalysis Science & Technology, 9(23), 6782-6792. https://doi.org/10.1039/c9cy01068h
Jakobsen, H. J., Bildsøe, H. K., Skibsted, J., Brorson, M., Hung, I. & Gan, Z. (2011). Synthesis of 17O-Labeled Cs2WO4 and Its Ambient- and Low-Temperature Solid-State 17O MAS NMR Spectra. Inorganic Chemistry, 50, 7676-7684. https://doi.org/10.1021/ic200722a
Villadsen, N. L., Jacobsen, K. M., Keiding, U., Weibel, E. T., Christiansen, B., Vosegaard, T., Bjerring, M., Jensen, F., Johannsen, M., Tørring, T. & Poulsen, T. (2017). Synthesis of ent-BE-43547A1 reveals a potent hypoxia-selective anticancer agent and uncovers the biosynthetic origin of the APD-CLD natural products. Nature Chemistry, 9(3), 264-272. https://doi.org/10.1038/nchem.2657
Mittag, T., Nielsen, N. C., Otzen, D. & Skrydstrup, T. (2009). Synthesis of a Ketomethylene Isostere of the Fibrillating Peptide SNNFGAILSS. Journal of Organic Chemistry, 74, 7955-7957.
Jepsen, L. H., Ban, V., Møller, K. T., Lee, Y.-S., Cho, Y. W., Besenbacher, F., Filinchuk, Y., Skibsted, J. & Jensen, T. R. (2014). Synthesis, Crystal Structure, Thermal Decomposition, and 11B MAS NMR Characterization of Mg(BH4)2(NH3BH 3)2. The Journal of Physical Chemistry Part C, 118(23), 12141-12153. https://doi.org/10.1021/jp502788j
Møller, K. T., Jørgensen, M., Andreasen, J. G., Skibsted, J., Łodziana, Z., Filinchuk, Y. & Jensen, T. R. (2018). Synthesis and thermal decomposition of potassium tetraamidoboranealuminate, K[Al(NH2BH3)4]. International Journal of Hydrogen Energy, 43(1), 311-321. https://doi.org/10.1016/j.ijhydene.2017.11.080
Sezgin, A., Bozkurt, A., Baykal, A., Akbey, U., Hansen, M. R. & Graf, R. (2008). Synthesis and NMR studies of the polymer membranes based on poly(4-vinylbenzylboronic acid) and phosphoric acid. Polymer, 49(18), 3859-3864. https://doi.org/10.1016/j.polymer.2008.07.002
Leth, K. T., Rovik, A. K., Holm, M. S., Brorson, M., Jakobsen, H. J., Skibsted, J. & Christensen, C. H. (2008). Synthesis and characterization of conventional and mesoporous Ga-MFI for ethane dehydrogenation. Applied Catalysis A: General, 348, 257-265.
Nielsen, A. B., Bjerring, M., Nielsen, J. T. & Nielsen, N. C. (2009). Symmetry-based dipolar recoupling by optimum control: Band selective experiments for assignment of solid-state NMR spectra of proteins. Journal of Chemical Physics, 131, 025101-1-025101-11. https://doi.org/10.1063/1.3157737
Pardo, P., Christensen, P. V., Keiding, K., Herfort, D. & Skibsted, J. (2011). Surface properties of calcined clays and their dispersion in blended Portland cement pastes. XIII International Congress on the Chemistry of Cement, 51.
Jakobsen, H. J., Bildsøe, H. K., Skibsted, J., Brorson, M. & Schaumburg, K. (2010). 95Mo MAS NMR of MoS2 Reveals Precise 95Mo Anisotropic Parameters from Its Central and Satellite Transitions for Characterizing Its Structure. Poster session presented at 14th Nordic Symposium on Catalysis, Helsingør, Denmark.
Jakobsen, H. J., Bildsøe, H. K., Skibsted, J., Brorson, M. & Schaumburg, K. (2010). 95Mo MAS NMR of MoS2 Reveals Precise 95Mo Anisotropic Parameters from Its Central and Satellite Transitions for Characterizing Its Structure. Poster session presented at 39th South Eastern Magnetic Resonance Conference , Gainesville, Florida, United States.
Jakobsen, H. J., Bildsøe, H. K., Skibsted, J., Brorson, M. & Schaumburg, K. (2010). 95Mo MAS NMR of MoS2 Reveals Precise 95Mo Anisotropic Parameters from Its Central and Satellite Transitions. Poster session presented at 51st ENC Conference, Daytona Beach, Florida, United States.
Goldbach, A., Fayon, F., Vosegaard, T., Wachhold, M., Kanatzidis, M. G., Massiot, D. & Saboungi, M.-L. (2003). 77Se and 87Rb solid state NMR study of the structure of Rb2[Pd(Se4)2].Se8. Inorg. Chem., 42, 6996-7000.
Larsen, F. H., Lipton, A., Jakobsen, H. J., Nielsen, N. C. & Ellis, P. D. (1999). 67Zn QCPMG solid-state NMR studies of zinc complexes as models for metalloproteins. Journal of the American Chemical Society, 121, 3783-3784.
Yde, C. C., Verstraeten, S. V. & Vosegaard, T. (2016). 31P NMR spectroscopy - strong interaction between wild bilberry components and cell membranes. Poster session presented at EUROMAR 2016, Aarhus, Denmark.
Vosegaard, T. & Jakobsen, H. J. (1997). 27Al Chemical Shielding Anisotropy. Journal of Magnetic Resonance, 128(2), 135-137. https://doi.org/10.1006/jmre.1997.1236
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
Sevelsted, T. F., Skibsted, J., Jakobsen, H. J. & Herfort, D. (2011). 13C MAS NMR spectroscopy in cement science: Characterization of limestone - Portland cements and carbonated C-S-H phases by 13C, 27Al and 29Si MAS NMR. In Proceedings of 31st cement and concrete science conference
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

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Revised 17.04.2023
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Lise Refstrup Linnebjerg Pedersen