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Institut for Kemi

Publikationer

Institut for Kemi er et af de mest produktive institutter på Aarhus Universitet. Der udgives et væld af artikler i videnskabelige tidsskrifter, som du finder herunder.

Publikationer fra Institut for Kemi

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Christensen, P. V., Hinge, M. & Keiding, J. K. (2009). The use of dielectrical spectroscopy in the investigation of the effect of polymer choice. Journal of Colloid and Interface Science, 133(1), 113-121.

Gras, E. M., Barroso, J. M., Besalu, E., Christiansen, O. & Luis, J. M. (2009). The vibrational auto-adjusting perturbation theory. Theoretical Chemistry Accounts, 123(1-2), 41-49.

Bremholm, M., Felicissimo, M. & Iversen, B. B. (2009). Time-Resolved In Situ Synchrotron X-ray Study and Large-Scale Production of Magnetite Nanoparticles in Supercritical Water. Angewandte Chemie International Edition, 48, 4788-4791.

Hinge, M., Pedersen, S. U., Kingshott, P. & Daasbjerg, K. (2009). Towards Durable Surface Coatings. I iNANO Annual Report 2008 (s. 25)

Hillerström, A., Andersson, M., Pedersen, J. S., Altskär, A., Langton, M., van Stam, J. & Kronberg, B. (2009). Transparency and Wettability of PVP/PDMS-INP Synthesized in Different Organic Solvents. Journal of Applied Polymer Science, 1828-1839.

Paixao, M. W., Holub, N., Vila, C., Nielsen, M. & Jørgensen, K. A. (2009). Trends in Organocatalytic Conjugate Addition to Enones: An Efficient Approach to Optically Active Alkynyl, Alkenyl and Ketone Products. Angewandte Chemie International Edition, 48, 7338.

Nielsen, J. T., Bjerring, M., Jeppesen, M., Pedersen, R. O., Pedersen, J. M., Hein, K. L., Vosegaard, T., Skrydstrup, T., Otzen, D. & Nielsen, N. C. (2009). Unique identification of supramolecular structures in amyloid fibrils by solid-state NMR spectroscopy. Angewandte Chemie International Edition, 48, 2118-2121.

Malmos, K., Dong, M., Pillai, S., Kingshott, P., Besenbacher, F., Pedersen, S. U. & Daasbjerg, K. (2009). Using a hydrazone-protected benzenediazonium salt to introduce a near-monolayer of benzaldehyde on glassy carbon surfaces. Journal of the American Chemical Society, 131(13), 4928-36. https://doi.org/10.1021/ja809816x

Nielsen, L. T., Cecatto, M., Holm, A. H., Kristensen, M. V., Pedersen, S. U. & Daasbjerg, K. (2009). Versatile Transformations of Alkylamine-derivatized glassy carbon electrodes using aryl isocyanates. Langmuir, 25(20), 12160-12168.

Seidler, P., Gras, E. M. & Christiansen, O. (2009). Vibrational coupled cluster theory with full two-mode and approximate three-mode couplings: The VCC[2pt3] model. Journal of Chemical Physics, 131, 034115.

Weijo, V., Hansen, M. B., Christiansen, O. & Manninen, P. (2009). Vibrational effects in the parity-violating contributions to the isotropic nuclear magnetic resonance chemical shift. Chemical Physics Letters, 470, 166-171.

Jordal, P. B., Dueholm, M. S., Larsen, P., Petersen, S. V., Enghild, J. J., Christiansen, G., Højrup, P., Nielsen, P. H. & Otzen, D. E. (2009). Widespread abundance of functional bacterial amyloid in mycolata and other gram-positive bacteria. Applied and Environmental Microbiology, 75(12), 4101-10. https://doi.org/10.1128/AEM.02107-08

Otzen, D., Sehgal, P. & Westh, P. (2009). α-lactalbumin is unfolded by all classes of detergents but with different mechanisms. Journal of Colloid and Interface Science, 329, 273-283.

Andersen, N. K., Spacilova, L., Jensen, M. D., Kocalka, P., Jensen, F. & Nielsen, P. (2008). A Click Chemistry Approach Towards Nucleic Acid Major Groove Functionalization. Nucleic Acids Symposium Series, (52), 149-150. https://doi.org/10.1093/nass/nrn076

J. Thorvaldsen, A., Ruud, K., Kristensen, K., Jørgensen, P. & Coriani, S. (2008). A density matrix-based quasienergy formulation of the Kohn-Sham density functional response theory using perturbation- and time-dependent basis sets. Journal of Chemical Physics, 129, 214108.

Dong, M. D., Hovgaard, M. B., Mamdouh, W., Xu, S. L., Otzen, D. E. & Besenbacher, F. (2008). AFM-based force spectroscopy measurements of mature amyloid fibrils of the peptide glucagon: Nanotechnology. Nanotechnology, 19(38).

Otzen, D., Nesgaard, L., Andersen, K. K., Hansen, J. H., Christiansen, G., Doe, H. & Sehgal, P. (2008). Aggregation of S6 in a quasi-native state by monomeric SDS. Biochimica et Biophysica Acta - Biomembranes, (1784), 400-414.

Andersen, K. K., Westh, P. & Otzen, D. (2008). A global study of myoglobin-surfactant interactions. Langmuir, 15, 399-407.

Høst, S., Jansik, B., Olsen, J., Jørgensen, P., Reine, S. & Helgaker, T. (2008). A ground-state directed optimization scheme for the Kohn-Sham energy. Physical Chemistry Chemical Physics, 10, 5344.

Hagemann, O., Bjerring, M., Nielsen, N. C. & Krebs, F. C. (2008). All solution processed tandem polymer solar cells based on thermocleavable materials. Solar Energy Materials & Solar Cells, 92(11), 1327-1335. https://doi.org/10.1016/j.solmat.2008.05.005

Elsner, P., Jiang, H., Nielsen, J. B., Pasi, F. & Jørgensen, K. A. (2008). A Modular and Organocatalytic Approach to γ-Butyrolactone Autoregulators from Streptomycetes. Chemical Communications, (44), 5827-5829. https://doi.org/10.1039/B812698D

Elsner, P., Jiang, H., Bjerg Nielsen, J., Pasi, F. & Jørgensen, K. A. (2008). A Modular and Organocatalytic Asymmetric Approach Towards the Synthesis of γ-Butyrolactone Autoregulators from Streptomycetes. Chemical Communications, 5827.

Toffoli, D. & Decleva, P. (2008). A multicentric approach to the calculation of nondipolar effects in molecular photoemission. Journal of Chemical Physics, 128(23), 234101.

Pedersen, J. S. & Otzen, D. (2008). Amyloid - a state in many guises: survival of the fittest fibril fold. Protein Science, 17, 1-9.

Larsen, P., Nielsen, J. L. & Otzen, D. (2008). Amyloid-like adhesins in floc-forming and filamentous bacteria in activated sludge. Applied and Environmental Microbiology, 74, 1517-1526.

Feixas, F., Gras, E. M., Solà, M. & Poater, J. (2008). Analysis of Hückel's [4n+2] Rule through Electronic Delocalization Measures. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 112, 13231-13238.

Glasius, M. (2008). Analysis of polar organic compounds in aerosols using HPLC-QTOF-MS. I C. Delval, MS. Johnson & A. Zardini (red.), The Ninth Informal Conference on Atmospheric Chemistry and Molecular Science Museum Tusculanum.

Ziolkowski, M., Weijo, V., Jørgensen, P. & Olsen, J. (2008). An efficient algorithm for solving nonlinear equations with a minimal number of trial vectors: Applications to atomic-orbital based coupled-cluster theory. Journal of Chemical Physics, 128, 204105.

Mallorquí-Fernández, N., Manandhar, SP., Mallorquí-Fernández, G., Usón, I., Wawrzonek, K., Kantyka, T., Solà, M., Thøgersen, I., Enghild, J. J., Potempa, J. & Gomis-Rüth, FX. (2008). A New Autocatalytic Activation Mechanism for Cysteine Proteases Revealed by Prevotella intermedia Interpain A. Journal of Biological Chemistry.

Jensen, T. R., Goncalves, A., Hazell, R. G. & Jakobsen, H. J. (2008). A new polymorph in the zinc phosphate Zn₂(HPO₄)₃ family prepared with DABCO as structure-directing agent. Microporous and Mesoporous Materials, 109, 383-391.

Gras, E. M. (2008). A new population analysis: Dipole-moment-conserving charge-set. Chemical Physics Letters, 451, 169-170.

Mantel, M., Søbjerg, L. S., Huynh, T. H. V., Ebran, J.-P., Lindhardt, A. T., Nielsen, N. C. & Skrydstrup, T. (2008). An Expedient Synthesis of the Fibril Binding Compound FSB via Sequential Pd-Catalyzed Coupling Reactions. Journal of Organic Chemistry, 73(9), 3570–3573. https://doi.org/10.1021/jo7026189

Bjerring, M., Nielsen, J. S., Siu, A., Nielsen, N. C. & Krebs, F. C. (2008). An explanation for the high stability of polycarboxythiophenes in photovoltaic devices - A by solid-state NMR dipolar recoupling study. Solar Energy Materials & Solar Cells, 92, 772-784. https://doi.org/10.1016/j.solmat.2007.11.008

Ferapontova, E. E., Olsen, E. M. & Gothelf, K. V. (2008). An RNA aptamer-based electrochemical biosensor for detection of theophylline in serum. Journal of the American Chemical Society, 130(13), 4256-4258. https://doi.org/10.1021/ja711326b

Cabrera, S., Aleman, J., Bolze, P., Bertelsen, S. & Jørgensen, K. A. (2008). An Unexpected Organocatalytic Tandem Michael-Morita-Baylis-Hilmann Reaction. Angewandte Chemie International Edition, 125.

Haaning, S., Radutoiu, S., Hoffmann, S. V., Dittmer, J., Giehm, L., Otzen, D. & Stougaard, J. (2008). An unusual intrinsically disordered protein from the model legume Lotus japonicus stabilizes proteins in vitro. Journal of Biological Chemistry, 283(45), 31142-52. https://doi.org/10.1074/jbc.M805024200

Dooleweerdt, K., Ruhland, T. & Skrydstrup, T. (2008). Application of Ynamides in the Synthesis of 2-Amidoindoles. Organic Letters, 11(1), 221-224.

Zackrisson, A. S., Pedersen, J. S. & Bergenholtz, J. (2008). A small-angle X-ray scattering study of aggregation and gelation of colloidal silica. Colloids and Surfaces A: Physicochemical and Engineering Aspects, 315, 23-30.

Hertel, O., Jensen, S. S., Hvidberg, M., Ketzel, M., Berkowicz, R., Palmgren, F., Wåhlin, P., Glasius, M., Loft, S., Vinzents, P., Raaschou-Nielsen, O., Sørensen, M. & Bak, H. (2008). Assessing the Impact of Traffic Air Pollution on Human Exposures and Linking Exposures to Health. I Road Pricing the Economy and the Environment (s. 277-299). Springer.

Aleman, J., Milelli, A., Cabrera, S., Reyes Martin, E. & Jørgensen, K. A. (2008). Asymmetric 1,4-Addition of Oxazolones to Nitroalkenes by Bifunctional Cinchona Alkaloid Thiourea Organocatalysts: Synthesis of α,α-Disubstituted α-Amino Acids. Chemistry - A European Journal, 14, 10958.

Afshari, NA., Bahadur, RP., Eifrig Jr, DE., Thøgersen, I., Enghild, J. J. & Klintworth, GK. (2008). Atypical asymmetric lattice corneal dystrophy associated with a novel homozygous mutation (Val624Met) in the TGFBI gene. Molecular Vision, 14(12).

Pajunen, T. I., Johansson, M. P., Hase, T. & Hopia, A. (2008). Autoxidation of Conjugated Linoleic Acid Methyl Ester in the Presence of α-Tocopherol: The Hydroperoxide Pathway. Lipids, 43, 599-610. https://doi.org/10.1007/s11745-008-3195-0

Hansen, M. B., Christiansen, O., Toffoli, D. & Kongsted, J. (2008). A virtual vibrational self-consistent-field method for efficient calculation of molecular vibrational partition functions and thermal effects on molecular properties. Journal of Chemical Physics, 128, 174106.

Christensen, M., Abrahamsen, A. B., Christensen, N. B., Juranyi, F., Andersen, N. H., Lefmann, K., Andersson, J., Bahl, C. R. H. & Iversen, B. B. (2008). Avoided Crossing of Rattler Modes in Thermoelectric Materials. Nature Materials, 7, 811-815.

Celik, L., Sinning, S., Severinsen, K., Hansen, C. G., Møller, M. S., Bols, M., Wiborg, O. & Schiøtt, B. (2008). Binding of Serotonin to the Human Serotonin Transporter. Molecular Modeling and Experimental Validation. Journal of the American Chemical Society, 3853-3865.

Shipovskov, S. & Ferapontova, E. (2008). Biocatalysis of theophylline oxidation by microbial theophylline oxidase in the presence of non-physiological electron acceptors. Biocatalysis and Biotransformation, 26(6), 508-518.

Andersen, C. S., Yan, H. & Gothelf, K. V. (2008). Bridging One Helical Turn in dsDNA by Templated Dimerization of Molecular Rods. Angewandte Chemie International Edition, 47, 5569-5572.

Garden, A. L., Halonen, L. & Kjærgaard, H. G. (2008). Calculated band profiles of the OH-stretching transitions in water dimer. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 112(32), 7439-7447.

Kjærgaard, H. G., Lane, J. R. & Vaida, V. (2008). Calculated electronic transitions of the water ammonia complex. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 128(3), 034202.

Kjærgaard, H. G., Garden, A. L., Chaban, G. M., Gerber, R. B., Matthews, D. A. & Stanton, J. F. (2008). Calculation of vibrational transition frequencies and intensities in water dimer: Comparison of different vibrational approaches. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 112(18), 4324-4335.

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Revideret 08.05.2026

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Institut for Kemi