Publications

Hsiao, Y.-W.; Sánchez-García, E.; Doerr, M.; Thiel, W. Quantum Refinement of Protein Structures: Implementation and Application to the Red Fluorescent Protein DsRed.M1. Journal of Physical Chemistry B 2010, 114, 15413–15423.

Mardyukov, A.; Crespo-Otero, R.; Sánchez-García, E.; Sander, W. Photochemistry and Reactivity of the Phenyl Radical-Water System: A Matrix Isolation and Computational Study. Chemistry-A European Journal 2010, 16, 8679–8689.

Sánchez-García, E.; Doerr, M.; Thiel, W. QM/MM Study of the Absorption Spectra of DsRed.M1 Chromophores. Journal of Computational Chemistry 2010, 31, 1603–1612.