Efeitos do solvente em transições de transferência de carga metal-ligante em complexo de rutênio(II) e suas interações com cisteína, glutationa e guanina
=== In this dissertation a theoretical study of the solvent effects on the structural an spectroscopic properties of the ruthenium complex [Ru(NH3)5L]2+ (L = pyrazine, pyz), was carried out, is employing the hybrid Monte Carlo/Quantum Mechanics simulations in the S-MC/MQ formalism, and Quantum Mole...
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| Format: | Others |
| Language: | Portuguese |
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Universidade Federal de Minas Gerais
2014
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| Online Access: | http://hdl.handle.net/1843/SFSA-9J3TU3 |