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Marcelo Tavares de Oliveira
Marcelo Tavares de Oliveira
Deakin University
Dirección de correo verificada de deakin.edu.au
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Año
Synthesis of triazole-linked pseudo-starch fragments
SA Nepogodiev, S Dedola, L Marmuse, et al.
Carbohydrate Research 342 (3-4), 364-369, 2007
562007
Do double-hybrid exchange–correlation functionals provide accurate chemical shifts? A benchmark assessment for proton NMR
MT de Oliveira, JMA Alves, AAC Braga, DJD Wilson, CA Barboza
Journal of Chemical Theory and Computation 17 (11), 6876-6885, 2021
512021
On the virtues of automated quantitative structure–activity relationship: the new kid on the block
MT de Oliveira, E Katekawa
Future medicinal chemistry 10 (3), 335-342, 2018
252018
Advances and progress in Chagas disease drug discovery
L G Ferreira, M T de Oliveira, A D Andricopulo
Current topics in medicinal chemistry 16 (20), 2290-2302, 2016
252016
Indirect approach to C-3 branched 1,2-cis-glycofuranosides: synthesis of aceric acid glycoside analogues
MT de Oliveira, DL Hughes, SA Nepogodiev, et al.
Carbohydrate Research 343 (2), 211-220, 2008
242008
Development of a pharmacophore for cruzain using oxadiazoles as virtual molecular probes: quantitative structure–activity relationship studies
AS de Souza, MT de Oliveira, AD Andricopulo
Journal of Computer-Aided Molecular Design 31, 801-816, 2017
182017
A comprehensive benchmark investigation of quantum chemical methods for carbocations
MT de Oliveira, JMA Alves, NL Vrech, AAC Braga, CA Barboza
Physical Chemistry Chemical Physics 25, 1903-1925, 2023
92023
Tri-n-butyltin hydride-mediated radical reaction of a 2-iodobenzamide: Formation of an unexpected carbon-tin bond
MT Oliveira, MAF Prado, RB Alves, et al.
Journal of the Brazilian Chemical Society 18 (2), 364-369, 2007
62007
Accelerating computations of organometallic reaction energies through hybrid basis sets
JMA Alves, IGR Domingos, MT de Oliveira
Inorganic Chemistry Frontiers 10 (8), 2262-2267, 2023
32023
Computer-based conformational analysis of acetylcholine and muscarine combined with an overview of the receptor-ligand interaction
MT de Oliveira, MA Santos, THA da Silva
Journal of Chemical Education 83 (5), 780-781, 2006
22006
Molecular modeling study of complexes between ferriprotoporphyrin IX and antimalarial 4-quinolinecarbinolamines: A proposal of pharmacophore.
THA da Silva, MT de Oliveira, HF dos Santos, et al.
Quimica Nova 28 (2), 244-249, 2005
22005
Good Practices in Database Generation for Benchmarking Density Functional Theory
A Karton, MT De Oliveira
Wiley Interdisciplinary Reviews: Computational Molecular Science 15 (1), e1737, 2025
2025
Prediction of 15N NMR chemical shifts for nitrogenated aromatic compounds
MT de Oliveira, JMA Alves, SFA Morais, AAC Bragab
Organic Chemistry, 113-122, 2020
2020
Book Review: Computational Toxicology. Risk Assessment for Pharmaceutical and Environmental Chemicals
MT De Oliveira
Frontiers in Pharmacology 10, 408, 2019
2019
Unravelling the stereoselectivity in 6-exo-trig radical cyclization of alpha,beta-unsaturated ester-tethered sugars. A tale of two stereocenters
MT de Oliveira, A Cesar, DHS Leal, et al.
Organic & Biomolecular Chemistry 8 (7), 1619-1622, 2010
2010
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