Lars Bo Stegeager Hemmingsen
Associate Professor
Department of Chemistry
Universitetsparken 5, 2100 København Ø, 73 Højhus 73, Building: 73-5-T563
Member of:
- 2000
- Published
A ¤chemical potential equalization model for treating polarization in molecular mechanical force fields
Bret, C., Field, M. J. & Hemmingsen, Lars Bo Stegeager, 2000, In: Molecular Physics. 98, 11, p. 751-763 13 p.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Density functional calculation of the electric field gradient in cadmium complexes: comparison with Hartree-Fock, second-order Møller-Plesset, and experimental results
Antony, J., Hansen, B., Hemmingsen, Lars Bo Stegeager & Bauer, R., 2000, In: Journal of Physical Chemistry A. 104, p. 6047-6055 9 p.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Importance of charge transfer and polarization effects for the modeling of uranyl-cation complexes
Hemmingsen, Lars Bo Stegeager, Amara, P., Ansoborlo, E. & Field, M. J., 2000, In: Journal of Physical Chemistry A. 104, p. 4095-4101 7 p.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Interaction and coordination geometries for Ag(I) in the two metal sites of hemocyanin
Holm, J. K., Hemmingsen, Lars Bo Stegeager, Bubacco, L., Salvato, B. & Bauer, R., 2000, In: FEBS Journal. 267, p. 1754-1760 7 p.Research output: Contribution to journal › Journal article › Research › peer-review
- 1999
- Published
Effects of the nuclear transformation 111Ag(I) to 111Cd(II) in a single crystal of Ag[111Ag] (imidazole)2NO3
Hansen, B., Bukrinsky, J. T., Hemmingsen, Lars Bo Stegeager, Bjerrum, Morten Jannik, Singh, K. & Bauer, R., 1999, In: Physical Review B Condensed Matter. 59, 22, p. 14182-14190 9 p.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Nuclear quadrupole interactions in cadmium complexes: semiempirical and ab initio calculations
Hemmingsen, Lars Bo Stegeager, Ryde, U. & Bauer, R., 1999, In: Zeitschrift für Naturforschung. Section A. 54, p. 422-430 9 p.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Plastocyanin binding to photosystem I as a function of the charge state of the metal ion: effect of metal site conformation
Danielsen, E., Scheller, H. V., Bauer, R., Hemmingsen, Lars Bo Stegeager, Bjerrum, Morten Jannik & Hansson, Ö., 1999, In: Biochemistry. 38, 35, p. 11531-11540 10 p.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Preference of Cd(II) and Zn(II) for the two metal sites in Bacillus cereus beta-lactamase II: a perturbed angular correlation of gamma-rays spectroscopic study
Paul-Soto, R., Zeppezauer, M., Adolph, H. W., Galleni, M., Frère, J., Carfi, A., Dideberg, O., Wouters, J., Hemmingsen, Lars Bo Stegeager & Bauer, R., 1999, In: Biochemistry. 38, p. 16500-16506 7 p.Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Structure, chemical bonding, and nuclear quadrupole interactions of beta-Cd(OH)2: experiment and first principles calculations
Hemmingsen, Lars Bo Stegeager, Bauer, R., Bjerrum, Morten Jannik, Schwarz, K., Blaha, P. & Andersen, P., 1999, In: Inorganic Chemistry. 38, 12, p. 2860-2867 8 p.Research output: Contribution to journal › Journal article › Research › peer-review
- 1997
- Published
Coordination geometries for monovalent and divalent metal ions in [His121]azurin: studies using perturbed angular correlations of gamma-rays from 111Ag and 111mCd
Danielsen, E., Kroes, S. J., Canters, G. W., Bauer, R., Hemmingsen, Lars Bo Stegeager, Singh, K. & Messerschmidt, A., 1997, In: FEBS Journal. 250, p. 249-259 11 p.Research output: Contribution to journal › Journal article › Research › peer-review
ID: 4233372
Most downloads
-
1620
downloads
Reparameterization of all-atom dipalmitoylphosphatidylcholine lipid parameters enables simulation of fluid bilayers at zero tension
Research output: Contribution to journal › Journal article › Research › peer-review
Published -
1083
downloads
Metal ion interaction of an oligopeptide fragment representing the regulatory metal binding site of a CueR protein
Research output: Contribution to conference › Poster › Research
Published -
765
downloads
TDPAC and β-NMR applications in chemistry and biochemistry
Research output: Contribution to journal › Journal article › Research › peer-review
Published