Published in
Royal Society of Chemistry, Physical Chemistry Chemical Physics, 44(17), p. 29880-29890, 2015
DOI: 10.1039/c5cp04563k
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Quantum chemical MP2 results on some hydrates of cytosine: binding sites, energies and the first hydration shell
Journal article published in 2015 by
Géza Fogarasi,
Péter G. Szalay 
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Abstract
A detailed quantum chemical investigation was undertaken to obtain the structure and energetics of cytosine hydrates Cyt·nH2O, with n = 1 to 7 based on MP2(fc)/aug-cc-pVDZ calculations.