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Solvent effects on the absorption spectra of arginine–salicylaldimine

✍ Scribed by S. Hisaindee; J. Graham; M.A. Rauf; M. Nawaz


Book ID
113805983
Publisher
Elsevier Science
Year
2012
Tongue
English
Weight
740 KB
Volume
169
Category
Article
ISSN
0167-7322

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✍ Maja Parac; Markus Doerr; Christel M. Marian; Walter Thiel 📂 Article 📅 2010 🏛 John Wiley and Sons 🌐 English ⚖ 348 KB

## Abstract Electronic spectra of guanine in the gas phase and in water were studied by quantum mechanical/molecular mechanical (QM/MM) methods. Geometries for the excited‐state calculations were extracted from ground‐state molecular dynamics (MD) simulations using the self‐consistent‐charge densit