Items where Author is "Sadeghian, Keyarash"
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Usvyat, Denis and Sadeghian, Keyarash and Maschio, Lorenzo and Schuetz, Martin (2012) Geometrical frustration of an argon monolayer adsorbed on the MgO (100) surface: An accurate periodic ab initio study. PHYSICAL REVIEW B, 86 (4): 045412. ISSN 2469-9950, 2469-9969
Sadeghian, Keyarash and Bocola, Marco and Schuetz, Martin (2011) Intermolecular Interactions in Photodamaged DNA from Density Functional Theory Symmetry-Adapted Perturbation Theory. CHEMPHYSCHEM, 12 (7). pp. 1251-1254. ISSN 1439-4235
Merz, Thomas and Sadeghian, Keyarash and Schuetz, Martin (2011) Why BLUF photoreceptors with roseoflavin cofactors lose their biological functionality. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 13 (32). pp. 14775-14783. ISSN 1463-9076, 1463-9084
Sadeghian, Keyarash and Bocola, Marco and Schuetz, Martin (2010) A QM/MM study on the fast photocycle of blue light using flavin photoreceptors in their light-adapted/active form. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 12 (31). pp. 8840-8846. ISSN 1463-9076, 1463-9084
Sadeghian, Keyarash and Bocola, Marco and Merz, Thomas and Schuetz, Martin (2010) Theoretical Study on the Repair Mechanism of the (6-4) Photolesion by the (6-4) Photolyase. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 132 (45). pp. 16285-16295. ISSN 0002-7863
Svoboda, Jiri and Koenig, Burkhard and Sadeghian, Keyarash and Schuetz, Martin (2008) 2 '-oxoethyl flavin revisited. ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, 63 (1). pp. 47-54. ISSN 0932-0776
Sadeghian, Keyarash and Bocola, Marco and Schuetz, Martin (2008) A conclusive mechanism of the photoinduced reaction cascade in blue light using flavin photoreceptors. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 130 (37). pp. 12501-12513. ISSN 0002-7863
Sadeghian, Keyarash and Schuetz, Martin (2007) On the photophysics of artificial blue-light photoreceptors: An ab initio study on a flavin-based dye dyad at the level of coupled-cluster response theory. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 129 (13). pp. 4068-4074. ISSN 0002-7863
