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Quantum mechanics/molecular mechanics calculation of the Raman spectra of the phycocyanobilin chromophore in alpha-c-phycocyanin

Mroginski, M. A., Mark, F., Thiel, W. and Hildebrandt, P.

Biophysical Journal 93, 1885–1894. 2007

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Metal-insulator phase transitions of SmNiO3 and PrNiO3: Electrons in a polaronic medium

Mroginski, M. A., Massa, N. E., Salva, H., Alonso, J. A. and Martinez-Lope, M. J.

Physical Review B 60, 5304–5311. 1999

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The chromophore structural changes during the photocycle of phytochrome: A combined resonance raman and quantum chemical approach

Mroginski, M. A., Murgida, D. H. and Hildebrandt, P.

Accounts Of Chemical Research 40, 258–266. 2007

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Calculation of vibrational spectra of linear tetrapyrroles. 4. Methine bridge C-H out-of-plane modes

Mroginski, M. A., Murgida, D. H. and Hildebrandt, P.

Journal Of Physical Chemistry A 110, 10564–10574. 2006

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Determination of the chromophore structures in the photoinduced reaction cycle of phytochrome

Mroginski, M. A., Murgida, D. H., von Stetten, D., Kneip, C., Mark, F. and Hildebrandt, P.

Journal Of The American Chemical Society 126, 16734–16735. 2004

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Calculation of vibrational spectra of linear tetrapyrroles. 3. Hydrogen-bonded hexamethylpyrromethene dimers

Mroginski, M. A., Nemeth, K., Bauschlicher, T., Klotzbucher, W., Goddard, R., Heinemann, O., Hildebrandt, P. and Mark, F.

Journal Of Physical Chemistry A 109, 2139–2150. 2005

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Calculation of the vibrational spectra of linear tetrapyrroles. 2. Resonance Raman spectra of hexamethylpyrromethene monomers

Mroginski, M. A., Nemeth, K., Magdo, I., Muller, M., Robben, U., Della Vedova, C., Hildebrandt, P. and Mark, F.

Journal Of Physical Chemistry B 104, 10885–10899. 2000

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Chromophore Structure of Cyanobacterial Phytochrome Cph1 in the Pr State: Reconciling Structural and Spectroscopic Data by QM/MM Calculations

Mroginski, M. A., von Stetten, D., Escobar, F. V., Strauss, H. M., Kaminski, S., Scheerer, P., Gunther, M., Murgida, D. H., Schmieder, P., Bongards, C., Gartner, W., Mailliet, J., Hughes, J., Essen, L. O. and Hildebrandt, P.

Biophysical Journal 96, 4153–4163. 2009

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Elucidating photoinduced structural changes in phytochromes by the combined application of resonance Raman spectroscopy and theoretical methods

Mroginski, M. A., von Stetten, D., Kaminski, S., Escobar, F. V., Michael, N., Daminelli-Widany, G. and Hildebrandt, P.

JOURNAL OF MOLECULAR STRUCTURE 993, 15-25. 2011

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The chromophore structures of the Pr states in plant and bacterial phytochromes

Murgida, D. H., von Stetten, D., Hildebrandt, P., Schwinte, P., Siebert, F., Sharda, S., Gartner, W. and Mroginski, M. A.

Biophysical Journal 93, 2410–2417. 2007

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