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S

Sylvio Canuto

Universidade de São Paulo

41H指数
361论文数
6.6K被引数
收录论文 59
发表时间
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Theoretical insights into the π→π∗ transition and the large Stokes shift of a curcumin-based chromophore基于姜黄素的发色团中π→π∗跃迁和大斯托克斯位移的理论见解
errTheoretical Chemistry Accounts
IF1.5
err2026-02-04
err0
errOAAI
errDe Araujo, Catharina B.; Oliveira, Lennon Rodrigues; Valverde, Danillo; Gester, Rodrigo; Coutinho, Kaline; Canuto, Sylvio; Manzoni, Vinicius
err分享
err收藏
Defining the pH* Scale in Methanol: Determination of Accurate Values for the Solvation Free Energies of CH3OH2+ and CH3O– in Methanol在甲醇中定义pH*标度：测定CH3OH2+和CH3O–在甲醇中的溶致自由能的准确值
errThe Journal of Physical Chemistry A
IF2.8
err2025-10-25
err0
errOAAI
errAntonio R. Cunha; José M. Riveros; Sylvio Canuto; Kaline Coutinho
err分享
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Antioxidant and chelating properties of phenolic compounds of agro-industrial waste of Carapa guianensis: theoretical insights for food and pharmaceutical applications卡帕拉·圭亚那ensis农业废弃物中酚类化合物的抗氧化和螯合特性：食品和制药应用的理论见解
errJOURNAL OF MOLECULAR MODELING
IF2.5
err2025-10-16
err0
PREAI
errdos Santos, Neidy S. S.; Surfin, Loubenky; Silva, William; Rodrigues da Cunha, Antonio; Georg, Herbert; Coutinho, Kaline; Canuto, Sylvio; Gester, Rodrigo
err分享
err收藏
Synthesis, Biotransformation, Characterization, and DFT Study of Organic Azachalcone Dyes and Secondary Metabolites with Biological and Conformation Dependence of Dipolar-Octupolar NLO Responses
errACS OMEGA
IF4.3
err2025-03-01
err0
errOAAI
errRibeiro, Victoria L.; dos Santos, Neidy S. S.; de Oliveira, Raira V. S.; Carvalho, Joselina A.; Garcia, Viviane V.; Brito-Junior, Hartmann J. S.; Usfinit, Willibrodus; Pinheiro, Mayra; Fill, Taicia; Gester, Rodrigo; Provasi, Patricio F.; Canuto, Sylvio; Bitencourt, Heriberto R.; Marinho, Patricia S. B.; Marinho, Andrey M. R.
err分享
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Using proton abstraction as a nonlinear optical amplifier in xanthone-based molecules: A DFT perspective以质子抽提作为基于香豆素分子的非线性光学放大器：一种DFT视角
errCHEMICAL PHYSICS LETTERS
IF3.1
err2025-02-01
err0
PREAI
errdos Santos, Neidy S. S.; Torres, Alberto; Georg, Herbert C.; Provasi, Patricio F.; Coutinho, Kaline; Canuto, Sylvio; Gester, Rodrigo
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err收藏
Elucidating the Photophysics and Nonlinear Optical Properties of a Novel Azo Prototype for Possible Photonic Applications: A Quantum Chemical Analysis
errACS OMEGA
IF4.3
err2024-09-20
err0
errOAAI
errFonseca, Savio; dos Santos, Neidy S. S.; Georg, Herbert C.; Fonseca, Tertius L.; Provasi, Patricio F.; Coutinho, Kaline; Canuto, Sylvio; da Cunha, Antonio R.; Gester, Rodrigo
err分享
err收藏
Theoretical and experimental study of a new antioxidant xanthone: Solvent and intramolecular hydrogen bond effects
errJOURNAL OF MOLECULAR LIQUIDS
IF5.2
err2024-08-01
err2
PREAI
errdos Santos, N. S. S.; Barbieri, H. B.; Pinheiro, M.; Fill, T. P.; Queiroz, M. H.; Pina, J.; Belo, E.; Georg, H. C.; da Cunha, A. R.; Marinho, P. S. B.; Marinho, A. M. R.; Coutinho, K.; Canuto, S.; Gester, R.
err分享
err收藏
Influence of Solvents and Halogenation on ESIPT of Benzimidazole Derivatives for Designing Turn-on Fluorescence Probes
errACS OMEGA
IF4.3
err2024-05-10
err5
errOAAI
errQueiroz, Murillo H.; Alves, Tiago V.; Rivelino, Roberto; Canuto, Sylvio
err分享
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Modulation of the NLO properties of p-coumaric acid by the solvent effects and proton dissociation
errJOURNAL OF MOLECULAR LIQUIDS
IF5.2
err2024-01-01
err6
PREAI
errDamasceno, Marcus V. A.; Cunha, Antonio R.; Provasi, Patricio F.; Pagola, Gabriel I.; Siqueira, Marcelo; Manzoni, Vinicius; Gester, Rodrigo; Canuto, Sylvio
err分享
err收藏
Calculation of the one- and two-photon absorption spectra of water-soluble stilbene derivatives using a multiscale QM/MM approach
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-07-13
err1
PREAI
errRamos, Tarcius N.; Franco, Leandro R.; Silva, Daniel L.; Canuto, Sylvio
err分享
err收藏
Ultrafast Intersystem Crossing Dynamics of 6-Selenoguanine in Water
errJACS AU
IF8.7
err2022-06-28
err15
errOAAI
errValverde, Danillo; Mai, Sebastian; Canuto, Sylvio; Borin, Antonio Carlos; Gonzalez, Leticia
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err收藏
Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-11-03
err4
PREAI
errAssis Oliveira, Leonardo Bruno; Fonseca, Tertius L.; Cabral, Benedito J. C.; Coutinho, Kaline; Canuto, Sylvio
err分享
err收藏
Free Energy Computation for an Isomerizing Chromophore in a Molecular Cavity via the Average Solvent Electrostatic Configuration Model: Applications in Rhodopsin and Rhodopsin-Mimicking Systems
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-08-11
err7
PREAI
errNikolaev, Dmitrii M.; Manathunga, Madushanka; Orozco-Gonzalez, Yoelvis; Shtyrov, Andrey A.; Guerrero Martinez, Yansel Omar; Gozem, Samer; Ryazantsev, Mikhail N.; Coutinho, Kaline; Canuto, Sylvio; Olivucci, Massimo
err分享
err收藏
A QM/MM study of the conformation stability and electronic structure of the photochromic switches derivatives of DHA/VHF in acetonitrile solution
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2021-04-01
err14
PREAI
errCardenuto, Marcelo Hidalgo; Cezar, Henrique M.; Mikkelsen, Kurt, V; Sauer, Stephan P. A.; Coutinho, Kaline; Canuto, Sylvio
err分享
err收藏
A new interpretation of the absorption and the dual fluorescence of Prodan in solution
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-12-22
err14
PREAI
errVequi-Suplicy, Cintia C.; Orozco-Gonzalez, Yoelvis; Lamy, M. Teresa; Canuto, Sylvio; Coutinho, Kaline
err分享
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Free energy gradient for understanding the stability and properties of neutral and charged L-alanine molecule in water
errJOURNAL OF MOLECULAR LIQUIDS
IF5.2
err2020-12-01
err6
PREAI
errLudwig, Valdemir; da Costa Ludwig, Zelia M.; Valverde, Danillo; Georg, Herbert C.; Canuto, Sylvio
err分享
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A theoretical study of the magnetic shielding of 15N of formamide in liquid water
errJOURNAL OF MOLECULAR LIQUIDS
IF5.2
err2020-12-01
err11
PREAI
errGester, Rodrigo; Damasceno, Marcus V. A.; Canuto, Sylvio; Manzoni, Vinicius
err分享
err收藏
Understanding the absorption spectrum of mesityl oxide dye in solvents of different polarities
errJOURNAL OF MOLECULAR LIQUIDS
IF5.2
err2020-06-01
err11
PREAI
errCezar, Henrique M.; Canuto, Sylvio; Coutinho, Kaline
err分享
err收藏
DICE: A Monte Carlo Code for Molecular Simulation Including the Configurational Bias Monte Carlo Method
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2020-05-29
err45
PREAI
errCezar, Henrique M.; Canuto, Sylvio; Coutinho, Kaline
err分享
err收藏
Unraveling the Electric Field-Induced Second Harmonic Generation Responses of Stilbazolium Ion Pairs Complexes in Solution Using a Multiscale Simulation Method
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2020-04-13
err16
PREAI
errRamos, Tarcius N.; Canuto, Sylvio; Champagne, Benoit
err分享
err收藏

研究方向

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合作学者
合作期刊
H
Hans Ågren
H 指数: 102 · 论文数: 1.6K
M
Massimo Olivucci
H 指数: 75 · 论文数: 419
H
Hans Lischka
H 指数: 74 · 论文数: 444
B
Benoı̂t Champagne
H 指数: 66 · 论文数: 813
K
Kurt V. Mikkelsen
H 指数: 62 · 论文数: 540
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