Exploring EPR parameters of 99Tc complexes for designing new MRI probes: coordination environment, solvent, and thermal effects on the spectroscopic properties

Pereira, Bruna T. L.; Silva, Érika Ferreira; Gonçalves, Mateus A.; Mancini, Daiana T.; Ramalho, Teodorico C.

Use este identificador para citar ou linkar para este item: http://repositorio.ufla.br/jspui/handle/1/29638

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Campo DC	Valor	Idioma
dc.creator	Pereira, Bruna T. L.	-
dc.creator	Silva, Érika Ferreira	-
dc.creator	Gonçalves, Mateus A.	-
dc.creator	Mancini, Daiana T.	-
dc.creator	Ramalho, Teodorico C.	-
dc.date.accessioned	2018-07-13T13:46:42Z	-
dc.date.available	2018-07-13T13:46:42Z	-
dc.date.issued	2017	-
dc.identifier.citation	PERIRA, B. T. L. et al. Exploring EPR parameters of 99Tc complexes for designing new MRI probes: coordination environment, solvent, and thermal effects on the spectroscopic properties. Journal of Chemistry, [S. l.], v. 2017, p. 1-8, 2017. doi: https://doi.org/10.1155/2017/8102812.	pt_BR
dc.identifier.uri	http://repositorio.ufla.br/jspui/handle/1/29638	-
dc.description.abstract	We have evaluated the solvent and thermal effects on spectroscopic parameters of 99Tc complexes coordinated to explicit water molecules. Molecular dynamics simulations were performed followed by hyperfine coupling constant calculations (). Our results show a significant increase of , which demonstrates that the studied compounds can be promising contrast agents in MRI.	pt_BR
dc.language	en_US	pt_BR
dc.publisher	Hindawi	pt_BR
dc.rights	acesso aberto	pt_BR
dc.rights.uri	http://creativecommons.org/licenses/by/4.0/	*
dc.source	Journal of Chemistry	pt_BR
dc.subject	Molecular dynamics	pt_BR
dc.subject	EPR Parameters	pt_BR
dc.subject	Spectroscopic properties	pt_BR
dc.subject	Dinâmica molecular	pt_BR
dc.subject	Parâmetros EPR	pt_BR
dc.subject	Propriedades espectroscópicas	pt_BR
dc.title	Exploring EPR parameters of 99Tc complexes for designing new MRI probes: coordination environment, solvent, and thermal effects on the spectroscopic properties	pt_BR
dc.type	Artigo	pt_BR
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