Original title:
Theoretical Study of Tautomeric Forms of Uracil and Their Interactions with Mg\hindex{2+}
Translated title:
Theoretical Study of Tautomeric Forms of Uracil and Their Interactions with Mg\hindex{2+}
Authors:
ROMANCOVÁ, Ingrid Document type: Bachelor's theses
Year:
2009
Language:
cze Abstract:
This bachelor thesis is focused on theoretical study of uracil tautomers and their interactions with bare and hydrated Mg2+ cation in the gas phase. The main aim was to find the most stable comlexes of Mg2+ ion with different uracil tautomers and compare their relative and interaction energies. A comparison with analogous Mg2+ complexes with thymine tautomers was also done and influence of the the metal ion hydration on the relative stability of the tautomers was evaluated.
Keywords:
computational chemistry; magnesium; uracil; hořčík; uracil; výpočetní chemie Citation: ROMANCOVÁ, Ingrid. Theoretical Study of Tautomeric Forms of Uracil and Their Interactions with Mg\hindex{2+}. České Budějovice, 2009. bakalářská práce (Bc.). JIHOČESKÁ UNIVERZITA V ČESKÝCH BUDĚJOVICÍCH. Přírodovědecká fakulta
Institution: University of South Bohemia in České Budějovice
(web)
Document availability information: Fulltext is available in the Digital Repository of University of South Bohemia. Original record: http://www.jcu.cz/vskp/11539