Shahi, A. and T. Domratcheva: Challenges in computing electron−transfer energies of DNA repair using hybrid QM/MM models. In: Journal of Chemical Theory and Computation 9, 10, 4644-4652 (2013).
doi: 10.1021%2Fct400537b
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fabs%2F10.1021%2Fct400537b
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Ffull%2F10.1021%2Fct400537b
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fpdfplus%2F10.1021%2Fct400537b
localid: 7930
Udvarhelyi, A. and T. Domratcheva: Glutamine rotamers in BLUF photoreceptors: a mechanistic reappraisal. In: Journal of Physical Chemistry B 117, 10, 2888-2897 (2013).
doi: 10.1021%2Fjp400437x
uri: http%3A%2F%2Fwww.ncbi.nlm.nih.gov%2Fpubmed%2F23421521
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Ffull%2F10.1021%2Fjp400437x
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fpdf%2F10.1021%2Fjp400437x
localid: 7893
Khrenova, M. G., A. V. Nemukhin and T. Domratcheva: Photoinduced electron transfer facilitates tautomerization of the conserved signaling glutamine side chain in BLUF protein light sensors. In: Journal of Physical Chemistry B 117, 8, 2369-2377 (2013).
doi: 10.1021%2Fjp312775x
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fabs%2F10.1021%2Fjp312775x
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Ffull%2F10.1021%2Fjp312775x
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fpdfplus%2F10.1021%2Fjp312775x
localid: 7839
Solov'yov, I. A., T. Domratcheva, A. Moughal Shahi and K. Schulten: Decrypting Cryptochrome: Revealing the Molecular Identity of the Photoactivation Reaction. In: Journal of the American Chemical Society 134, 43, 18046-18052 (2012).
doi: 10.1021%2Fja3074819
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fabs%2F10.1021%2Fja3074819
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Ffull%2F10.1021%2Fja3074819
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fpdfplus%2F10.1021%2Fja3074819
localid: 7831
Khrenova, M. G., T. Domratcheva, I. Schlichting, B. L. Grigorenko and A. V. Nemukhin: Computational Characterization of Reaction Intermediates in the Photocycle of the Sensory Domain of the AppA Blue Light Photoreceptor. In: Photochemistry and Photobiology (2011).
doi: 10.1111%2Fj.1751-1097.2010.00861.x
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fabstract
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Ffull
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fpdf
localid: 7652
Khrenova, M. G., T. Domratcheva, I. Schlichting, B. L. Grigorenko and A. V. Nemukhin: Computational Characterization of Reaction Intermediates in the Photocycle of the Sensory Domain of the AppA Blue Light Photoreceptor. In: Photochemistry and Photobiology (2011).
doi: 10.1111%2Fj.1751-1097.2010.00861.x
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fabstract
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Ffull
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fpdf
localid: 7652
Khrenova, M. G., T. Domratcheva, I. Schlichting, B. L. Grigorenko and A. V. Nemukhin: Computational Characterization of Reaction Intermediates in the Photocycle of the Sensory Domain of the AppA Blue Light Photoreceptor. In: Photochemistry and Photobiology (2011).
doi: 10.1111%2Fj.1751-1097.2010.00861.x
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fabstract
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Ffull
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fpdf
localid: 7652
Khrenova, M. G., T. Domratcheva, I. Schlichting, B. L. Grigorenko and A. V. Nemukhin: Computational Characterization of Reaction Intermediates in the Photocycle of the Sensory Domain of the AppA Blue Light Photoreceptor. In: Photochemistry and Photobiology (2011).
doi: 10.1111%2Fj.1751-1097.2010.00861.x
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fabstract
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Ffull
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fpdf
localid: 7652
Khrenova, M. G., T. Domratcheva, I. Schlichting, B. L. Grigorenko and A. V. Nemukhin: Computational Characterization of Reaction Intermediates in the Photocycle of the Sensory Domain of the AppA Blue Light Photoreceptor. In: Photochemistry and Photobiology (2011).
doi: 10.1111%2Fj.1751-1097.2010.00861.x
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fabstract
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Ffull
uri: http%3A%2F%2Fonlinelibrary.wiley.com%2Fdoi%2F10.1111%2Fj.1751-1097.2010.00861.x%2Fpdf
localid: 7652
Domratcheva, T.: Neutral Histidine and Photoinduced Electron Transfer in DNA Photolyases. In: Journal of the American Chemical Society 133, 45, 18172-18182 (2011).
doi: 10.1021%2Fja203964d
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fabs%2F10.1021%2Fja203964d
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Ffull%2F10.1021%2Fja203964d
uri: http%3A%2F%2Fpubs.acs.org%2Fdoi%2Fpdfplus%2F10.1021%2Fja203964d
localid: 7730
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