| dc.contributor.advisor | Chval, Zdeněk | |
| dc.contributor.author | Romancová, Ingrid | |
| dc.date.accessioned | 2021-12-06T13:07:19Z | |
| dc.date.available | 2021-12-06T13:07:19Z | |
| dc.date.issued | 2009 | |
| dc.date.submitted | 2009-04-30 | |
| dc.identifier.uri | https://dspace.jcu.cz/handle/20.500.14390/23282 | |
| dc.description.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. | cze |
| dc.format | 68 s. | |
| dc.format | 68 s. | |
| dc.language.iso | cze | |
| dc.publisher | Jihočeská univerzita | cze |
| dc.rights | Bez omezení | |
| dc.subject | uracil | cze |
| dc.subject | hořčík | cze |
| dc.subject | výpočetní chemie | cze |
| dc.subject | uracil | eng |
| dc.subject | magnesium | eng |
| dc.subject | computational chemistry | eng |
| dc.title | Theoretical Study of Tautomeric Forms of Uracil and Their Interactions with Mg<sup>2+</sup> | cze |
| dc.title.alternative | Theoretical Study of Tautomeric Forms of Uracil and Their Interactions with Mg<sup>2+</sup> | eng |
| dc.type | bakalářská práce | cze |
| dc.identifier.stag | 11539 | |
| dc.description.abstract-translated | 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. | eng |
| dc.date.accepted | 2009-06-01 | |
| dc.description.department | Přírodovědecká fakulta | cze |
| dc.thesis.degree-discipline | Biofyzika | cze |
| dc.thesis.degree-grantor | Jihočeská univerzita. Přírodovědecká fakulta | cze |
| dc.thesis.degree-name | Bc. | |
| dc.thesis.degree-program | Biofyzika | cze |
| dc.description.grade | Dokončená práce s úspěšnou obhajobou | cze |
| dc.contributor.referee | Kabeláč, Martin | |
