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Data do documentoTítuloAutor(es)
2018Adsorption of diclofenac on a magnetic adsorbent based on maghemite: experimental and theoretical studiesLeone, V. O.; Pereira, M. C.; Aquino, S. F.; Oliveira, L. C. A.; Correa, S.; Ramalho, T. C.; Gurgela, L. V. A.; Silva, A. C.
2022Ciprofloxacin/Topoisomerase-II complex as a promising dual UV–Vis/fluorescent probe: accomplishments and opportunities for the cancer diagnosisSales, T. A.; Ramalho, T. C.
2012Computational insights into the role of the frontiers orbital in the chemistry of tridentate ligandsLa Porta, F. A.; Giacoppo, J. O. S.; Ramos, P. H.; Ramalho, T. C.
Out-2009Construction and assessment of reaction models of class I EPSP synthase: molecular docking and density functional theoretical calculationsRamalho, T. C.; Caetano, M. S.; Cunha, E. F. da; Souza, T. C.; Rocha, M. V.
Mai-2018Etherification of hydroxymethylfurfural with preyssler heteropolyacids immobilized on magnetic compositesPardo, O. H.; Rojas, H. A.; Ramalho, T. C.; Afonso, C. A.; Romanelli, G. P.; Martinez, J. J.
15-Jan-2016Methane C–H bond activation by niobium oxides: theoretical analyses of the bonding and reactivity properties of Nbomn+(m = 1, 2; n = 0, 1, 2)Almeida, K. J. de; Silva, T. C.; L. Neto, J.; Rocha, M. V. J.; Ramalho, T. C.; Miranda, M. N. de; Duarte, H. A.
Jan-2016Methane C–H bond activation by niobium oxides: theoretical analyses of the bonding and reactivity properties of NbOn+m (m = 1, 2; n = 0, 1, 2)Almeida, Katia Julia de; Silva, T. C.; Leal Neto, Jonas; Rocha, M. V. J.; Ramalho, T. C.; Miranda, M. N. de; Duarte, Hélio Anderson
2013Methane dehydrogenation by niobium ions: a first-principles study of the gas-phase catalytic reactionsAlmeida, K. J. de; Ramalho, T. C.; Leal Neto, J.; Santiago, R. T.; Felicíssimo, V. C.; Duarte, H. A.
5-Out-2016Predicting Pt‐195 NMR chemical shift using new relativistic all‐electron basis setPaschoal, D.; Guerra, C. Fonseca; Oliveira, M. A. L. de; Ramalho, T. C.; Santos, H. F. dos
Mar-2023Prospects of ZnS and ZnO as smart semiconductor materials in light-activated antimicrobial coatings for mitigation of severe acute respiratory syndrome coronavirus-2 infectionBenatto, V. G.; Jesus, J. P. A. de; Castro, A. A. de; Assis, L. C.; Ramalho, T. C.; La Porta, F. A.
Ago-2014Single and double ionization of the camphor molecule excited around the C 1s edgeCastilho, R. B. de; Ramalho, T. C.; Nunez, C. V.; Coutinho, L. H.; Santos, A. C. F.; Pilling, S.; Lago, A. F.; Silva‐Moraes, M. O.; Souza, G. G. B. de
Abr-2014Síntese e caracterização de um novo material adsorvente produzido a partir de resíduos de pneu para a remoção de contaminantes em solução aquosaLa Porta, F. A.; Giacoppo, J. O. S.; Ramalho, T. C.
Jul-2012Theoretical insights into the visible near‐infrared absorption spectra of Bis (hexafluoroacetylacetonate) copper(II) in pyridineAlmeida, K. J. de; Ramalho, T. C.; Alves, M. C.; Vahtras, O.
5-Set-2017Theoretical spectroscopic insights of tautomers and enantiomers of penicillamineMendes, J.; Almeida, K. J. de; L. Neto, J.; Ramalho, T. C.; Duarte, H. A.
Fev-2011Theoretical study of specific solvent effects on the optical and magnetic properties of copper(II) acetylacetonateAlmeida, K. J. de; Ramalho, T. C.; Rinkevicius, Z.; Vahtras, O.; Ågren, H.; Cesar, A.
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