Boron as a promoter in the goethite (α-FeOOH) phase: Organic compound degradation by Fenton reaction AM Mesquita, IR Guimarães, GMM de Castro, MA Goncalves, ... Applied Catalysis B: Environmental 192, 286-295, 2016 | 88 | 2016 |
Optimal wavelet signal compression as an efficient alternative to investigate molecular dynamics simulations: application to thermal and solvent effects of MRI probes MA Gonçalves, LS Santos, DM Prata, FC Peixoto, EFF da Cunha, ... Theoretical Chemistry Accounts 136, 1-13, 2017 | 51 | 2017 |
Dynamics, NMR parameters and hyperfine coupling constants of the Fe3O4 (1 0 0)–water interface: Implications for MRI probes MA Goncalves, FC Peixoto, EFF da Cunha, TC Ramalho Chemical Physics Letters 609, 88-92, 2014 | 31 | 2014 |
Synthesis and comparison of antileishmanial and cytotoxic activities of S-(−)-limonene benzaldehyde thiosemicarbazones with their R-(+)-analogues SAA Batista, F Vandresen, H Falzirolli, E Britta, DN de Oliveira, ... Journal of Molecular Structure 1179, 252-262, 2019 | 28 | 2019 |
Probing thermal and solvent effects on hyperfine interactions and spin relaxation rate of δ-FeOOH (1 0 0) and [MnH3buea (OH)] 2−: Toward new MRI probes MA Gonçalves, EFF da Cunha, FC Peixoto, TC Ramalho Computational and Theoretical Chemistry 1069, 96-104, 2015 | 21 | 2015 |
Structural, inorganic, and adsorptive properties of hydrochars obtained by hydrothermal carbonization of coffee waste MS Santana, RP Alves, LS Santana, MA Gonçalves, MC Guerreiro Journal of Environmental Management 302, 114021, 2022 | 20 | 2022 |
Improved protocol for the selection of structures from molecular dynamics of organic systems in solution: the value of investigating different wavelet families MA Gonçalves, AS Gonçalves, TCC Franca, MS Santana, EFF da Cunha, ... Journal of Chemical Theory and Computation 18 (10), 5810-5818, 2022 | 17 | 2022 |
NMR relaxation and relaxivity parameters of MRI probes revealed by optimal wavelet signal compression of molecular dynamics simulations MA Gonçalves, LS Santos, FC Peixoto, TC Ramalho International Journal of Quantum Chemistry 119 (10), e25896, 2019 | 16 | 2019 |
Use of ethylenediaminetetraacetic acid as a scavenger for chromium from “wet blue” leather waste: Thermodynamic and kinetics parameters JE Resende, MA Gonçalves, LCA Oliveira, EFF da Cunha, TC Ramalho Journal of Chemistry 2014, 2014 | 16 | 2014 |
Iron and molybdenum mixed oxide supported on Al-PILC for the catalytic oxidative desulfurization of dibenzothiophene in simulated diesel fuel AA Tireli, I do Rosário Guimarães, G Mello Mattos de Castro, ... Environmental Science and Pollution Research 27, 14963-14976, 2020 | 14 | 2020 |
Comparing structure and dynamics of solvation of different iron oxide phases for enhanced magnetic resonance imaging MA Gonçalves, LS Santos, FC Peixoto, EFF da Cunha, TC Silva, ... ChemistrySelect 2 (31), 10136-10142, 2017 | 14 | 2017 |
Molecular modeling studies of piperidine derivatives as new acetylcholinesterase inhibitors against neurodegenerative diseases EFF da Cunha, JE Resende, TCC Franca, MA Gonçalves, FR de Souza, ... Journal of Chemistry 2013, 2013 | 14 | 2013 |
Chitosan-iron oxide hybrid composite: mechanism of hexavalent chromium removal by central composite design and theoretical calculations PMB Chagas, AA Caetano, MA Rossi, MA Gonçalves, ... Environmental Science and Pollution Research 26, 15973-15988, 2019 | 12 | 2019 |
Value of NMR relaxation parameters of diamagnetic molecules for quantum information processing: Optimizing the coherent phase JB dos Reis Lino, MA Gonçalves, TC Ramalho Theoretical Chemistry Accounts 140 (1), 8, 2021 | 11 | 2021 |
Theoretical structural and electronic analyses with emphasis on the reactivity of iron oxide prototypes in methane C–H bond activation TC Silva, KJ de Almeida, M dos Santos Pires, AA de Castro, ... Reaction Kinetics, Mechanisms and Catalysis 120, 195-208, 2017 | 10 | 2017 |
First Attempts of the Use of 195Pt NMR of Phenylbenzothiazole Complexes as Spectroscopic Technique for the Cancer Diagnosis BTL Pereira, MA Gonçalves, DT Mancini, K Kuca, TC Ramalho Molecules 24 (21), 3970, 2019 | 8 | 2019 |
Exploring EPR Parameters of 99Tc Complexes for Designing New MRI Probes: Coordination Environment, Solvent, and Thermal Effects on the Spectroscopic … BTL Pereira, EF Silva, MA Goncalves, DT Mancini, TC Ramalho Journal of Chemistry 2017, 2017 | 8 | 2017 |
Agentes de Contraste para Imagem por Ressonância Magnética: Uma Revisão MA Gonçalves, CT Ramalho Revista Virtual de Química 9 (4), 1511-1524, 2017 | 7 | 2017 |
Simultaneous pancreas-kidney transplantation: which organ should be transplanted first? A Salzedas-Netto, M Linhares, G Lopes-Filho, C Melaragno, J De Sa, ... Transplantation proceedings 42 (7), 2647-2649, 2010 | 7 | 2010 |
Extending NMR Quantum Computation Systems by Employing Compounds with Several Heavy Metals as Qubits JBR Lino, MA Gonçalves, SPA Sauer, TC Ramalho Magnetochemistry 8 (5), 47, 2022 | 6 | 2022 |