Publications by authors named "Leonardo Duarte"

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Public perception on climate change: Analyzing impact of IPCC reports via topic modeling with NMF and sentiment analysis.
Beatriz V B S Souza, Leonardo T Duarte, Priscila P Coltri

An Acad Bras Cienc· December 2025

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Analysis of DNA methyltransferase 3 alpha expression during respiratory syncytial virus strain A infection.
André Luiz Becker, Sofia Giacomet Borges, Lucas Gabriel Rodrigues Pinheiro, Deise Nascimento Freitas, Leonardo Duarte, Ana Paula Duarte de Souza

Sci Rep· December 2025

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Enantioselective Synthesis of 3,3-Disubstituted-2,3-dihydrobenzofurans by Intramolecular Heck-Matsuda/Carbonylation/Stille Coupling.
Luiz Paulo Melchior de Oliveira Leão, Otto Daolio Köster, Leonardo José Duarte, Ataualpa Albert Carmo Braga, Carlos Roque Duarte Correia

J Org Chem· July 2025

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Energetic Origins of the Hydrogen-Bond Redshift: IQA Partitioning of Normal Mode Force Constants.
Leonardo J Duarte, Erick H S Alves, Ataualpa A C Braga

J Phys Chem A· July 2025

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Performance Assessment of Change Detection Based on Robust PCA for Wavelength Resolution SAR Images Using Nonidentical Flight Passes.
Lucas P Ramos, Viet T Vu, Mats I Pettersson, Patrik Dammert, Leonardo T Duarte

Sensors (Basel)· April 2025

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A protocol for the investigation of the intramolecular vibrational energy redistribution problem: the isomerization of nitrous acid as a case of study.
Leonardo J Duarte, Cláudio M Nunes, Rui Fausto, Ataualpa A C Braga

Phys Chem Chem Phys· February 2025

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Do good things really come to those who wait? An analysis of the average time of acceptance in Brazilian surgery journals.
Lívia Guerreiro de Barros Bentes, Maria Fernanda de Almeida Cavalcante Aranha, Mariana Kondo Obara, Larissa Yoshie Shibata, Pablo Rodrigues Nunes de Souza, Leonardo Barbosa Duarte

Acta Cir Bras· July 2024

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H NMR Mixture Design-Fingerprints and ASCA Analysis in : Model Stability in Search of a Global Metabolome.
Gustavo Galo Marcheafave, Elis Daiane Pauli, Cláudia Domiciano Tormena, Leonardo José Duarte, Ivar Wendling

Anal Chem· November 2023

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Characteristic Substituent Effect Model for the Infrared Intensities of the XCY (X = H, F, Cl, Br; Y = O, S) Molecules.
Leonardo J Duarte, Wagner E Richter, Roy E Bruns

J Phys Chem A· April 2023

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Energetic Origins of Force Constants: Adding a New Dimension to the Hessian Matrix via Interacting Quantum Atoms.
Leonardo J Duarte, Roy E Bruns

J Phys Chem A· December 2022

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Infrared intensities of : a true challenge for DFT methods.
Wagner E Richter, Leonardo J Duarte

J Mol Model· September 2022

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An Interacting Quantum Atoms (IQA) and Relative Energy Gradient (REG) Analysis of the Anomeric Effect.
Danish Khan, Leonardo J Duarte, Paul L A Popelier

Molecules· August 2022

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Towards an atomistic understanding of polymorphism in molecular solids.
Arturo Sauza-de la Vega, Leonardo J Duarte, Arnaldo F Silva, Jonathan M Skelton, Tomás Rocha-Rinza

Phys Chem Chem Phys· May 2022

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Unavoidable failure of point charge descriptions of electronic density changes for out-of-plane distortions.
Wagner E Richter, Leonardo J Duarte, Roy E Bruns

Spectrochim Acta A Mol Biomol Spectrosc· April 2022

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Electronic Distribution of S2 IRC and TS Structures: Infrared Intensities of Imaginary Frequencies.
Leonardo J Duarte, Roy E Bruns

J Chem Theory Comput· April 2022

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Short-chain fatty acid acetate triggers antiviral response mediated by RIG-I in cells from infants with respiratory syncytial virus bronchiolitis.
Krist H Antunes, Renato T Stein, Caroline Franceschina, Emanuelle F da Silva, Deise N de Freitas, Leonardo Duarte

EBioMedicine· March 2022

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Electrostatics Explains the Reverse Lewis Acidity of BH and Boron Trihalides: Infrared Intensities and a Relative Energy Gradient (REG) Analysis of IQA Energies.
Leonardo J Duarte, Wagner E Richter, Roy E Bruns, Paul L A Popelier

J Phys Chem A· October 2021

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Are "GAPT Charges" Really Just Charges?
Wagner E Richter, Leonardo J Duarte, Roy E Bruns

J Chem Inf Model· August 2021

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Atomic charge and atomic dipole modeling of gas-phase infrared intensities of fundamental bands for out-of-plane CH and CF bending vibrations.
Wagner E Richter, Leonardo J Duarte, Roy E Bruns

Spectrochim Acta A Mol Biomol Spectrosc· April 2021

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AC/DC Analysis: Broad and Comprehensive Approach to Analyze Infrared Intensities at the Atomic Level.
Wagner E Richter, Leonardo J Duarte, Luciano N Vidal, Roy E Bruns

J Phys Chem A· April 2021

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Quantum chemical intensity determinations of overlapped gas phase infrared bands.
Leonardo J Duarte, Wagner E Richter, Arnaldo F Silva, Roy E Bruns

Spectrochim Acta A Mol Biomol Spectrosc· April 2020

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QTAIM Atomic Charge and Polarization Parameters and Their Machine-Learning Transference among Boron-Halide Molecules.
Leonardo J Duarte, Roy E Bruns

J Phys Chem A· April 2020

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A Video-Based Framework for Automatic 3D Localization of Multiple Basketball Players: A Combinatorial Optimization Approach.
Lucas Antônio Monezi, Anderson Calderani Junior, Luciano Allegretti Mercadante, Leonardo Tomazeli Duarte, Milton S Misuta

Front Bioeng Biotechnol· April 2020

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Complex Networks Models and Spectral Decomposition in the Analysis of Swimming Athletes' Performance at Olympic Games.
Vanessa Helena Pereira-Ferrero, Theodore Gyle Lewis, Luciane Graziele Pereira Ferrero, Leonardo Tomazeli Duarte

Front Physiol· September 2019

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Infrared Intensification and Hydrogen Bond Stabilization: Beyond Point Charges.
Leonardo J Duarte, Arnaldo F Silva, Wagner E Richter, Roy E Bruns

J Phys Chem A· August 2019

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