Takip et
Gustavo Troiano Feliciano
Gustavo Troiano Feliciano
Max-Planck-Institut für Kohlenforschung - Department of Molecular Theory and Spectroscopy
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Başlık
Alıntı yapanlar
Alıntı yapanlar
Yıl
Thermally activated charge transport in microbial protein nanowires
S Lampa-Pastirk, JP Veazey, KA Walsh, GT Feliciano, RJ Steidl, ...
Scientific reports 6 (1), 23517, 2016
1232016
Structural and functional insights into the conductive pili of Geobacter sulfurreducens revealed in molecular dynamics simulations
GT Feliciano, RJ Steidl, G Reguera
Physical Chemistry Chemical Physics 17 (34), 22217-22226, 2015
1072015
Molecular and Electronic Structure of the Peptide Subunit of Geobacter sulfurreducens Conductive Pili from First Principles
GT Feliciano, AJR da Silva, G Reguera, E Artacho
The Journal of Physical Chemistry A 116 (30), 8023-8030, 2012
842012
Capacitive DNA detection driven by electronic charge fluctuations in a graphene nanopore
GT Feliciano, C Sanz-Navarro, MD Coutinho-Neto, P Ordejón, ...
Physical Review Applied 3 (3), 034003, 2015
752015
Capacitance spectroscopy and density functional theory
PR Bueno, GT Feliciano, JJ Davis
Physical Chemistry Chemical Physics 17 (14), 9375-9382, 2015
582015
Theoretical assessment of feasibility to sequence DNA through interlayer electronic tunneling transport at aligned nanopores in bilayer graphene
J Prasongkit, GT Feliciano, AR Rocha, Y He, T Osotchan, R Ahuja, ...
Scientific reports 5 (1), 17560, 2015
552015
Semi-empirical quantum chemistry method for pre-polymerization rational design of ciprofloxacin imprinted polymer and adsorption studies
LD Marestoni, A Wong, GT Feliciano, MRR Marchi, CRT Tarley, ...
Journal of the Brazilian Chemical Society 27 (1), 109-118, 2016
372016
Mapping the ionic fingerprints of molecular monolayers
J Lehr, JR Weeks, A Santos, GT Feliciano, MIG Nicholson, JJ Davis, ...
Physical Chemistry Chemical Physics 19 (23), 15098-15109, 2017
292017
The role of water on the electronic transport in graphene nanogap devices designed for DNA sequencing
E de Freitas Martins, RG Amorim, GT Feliciano, RH Scheicher, AR Rocha
Carbon 158, 314-319, 2020
252020
Addressing the Environment Electrostatic Effect on Ballistic Electron Transport in Large Systems: A QM/MM-NEGF Approach
GT Feliciano, C Sanz-Navarro, MD Coutinho-Neto, P Ordejón, ...
The Journal of Physical Chemistry B 122 (2), 485-492, 2017
252017
Effect of dimerization on the mechanism of action of aurein 1.2
EN Lorenzón, KA Riske, GF Troiano, GCA Da Hora, TA Soares, EM Cilli
Biochimica et Biophysica Acta (BBA)-Biomembranes 1858 (6), 1129-1138, 2016
242016
Exploring coupled redox and pH processes with a force-field-based approach: applications to five different systems
VWD Cruzeiro, GT Feliciano, AE Roitberg
Journal of the American Chemical Society 142 (8), 3823-3835, 2020
172020
Optical and electronic properties of TiO2/GOQDs composites: A combined experimental and first-principles calculations study
VR Jauja-Ccana, AVC Huamán, GT Feliciano, ALRT Gómez
Computational Materials Science 195, 110503, 2021
162021
Unravelling the reaction mechanism of matrix metalloproteinase 3 using QM/MM calculations
GT Feliciano, AJR da Silva
Journal of Molecular Structure 1091, 125-132, 2015
162015
Experimental and theoretical studies of volatile corrosion inhibitors adsorption on zinc electrode
DA Teixeira, MAG Valente Jr, AV Benedetti, GT Feliciano, SC Silva, ...
Journal of the Brazilian Chemical Society 26 (3), 434-450, 2015
142015
Three-dimensional catalysis and the efficient bioelectrocatalysis beyond surface chemistry
LJA Macedo, AAE Santo, GC Sedenho, A Hassan, RM Iost, GT Feliciano, ...
Journal of Catalysis 401, 200-205, 2021
132021
Development of a selective molecularly imprinted polymer for troponin T detection: a theoretical-experimental approach
LCS Neres, GT Feliciano, RF Dutra, MDPT Sotomayor
Materials Today Communications 30, 102996, 2022
122022
Molecular dynamics investigation of the structural and energetic properties of CeO 2–MO x (M= Gd, La, Ce, Zr) nanoparticles
JPA De Mendonca, TC Lourenço, LPM Freitas, AAE Santo, GT Feliciano, ...
Materials Advances 2 (23), 7759-7772, 2021
122021
Ab Initio QM/MM Simulation of Ferrocene Homogeneous Electron-Transfer Reaction
MIG Nicholson, PR Bueno, GT Feliciano
The Journal of Physical Chemistry A 125 (1), 25-33, 2020
122020
Atomic and Electronic Structure of Pilus from Geobacter sulfurreducens through QM/MM Calculations: Evidence for Hole Transfer in Aromatic Residues
LP Mezzina Freitas, GT Feliciano
The Journal of Physical Chemistry B 125 (30), 8305-8312, 2021
112021
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