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ARECCHI, F. T. ; EUZZOR, S. ; GALLAS, M. R. ; GALLAS, J. A. C. ; MEUCCI, R. ; PUGLIESE, E. ; ZAMBRANO, S.; Exploring phase control with square pulsed perturbations; European Physical Journal-Special Topics, v. 226, p. 1785-1790, 2017

C. ABRAHAM T.-CHAVEZ; BENITO VARGAS; ANDREA CENTELLAS VILLARROEL; Kneading spirals and hubs of stable orbits in a chaotic circuit model; PRE

CAMILA ISERHARDT, FELIPE S. S. SCHNEIDER, GIOVANNI F. CARAMORI AND MAXIMILIANO SEGALA; DFT models for first step of the Chemoselective Hydrogenation of Substituted Aldehydes Using Silver Nanoparticles as Catalyst; Simpósio Brasileira de Química Teórica

C.B. PICOLOTO, R.D. DA CUNHA, R.C. BARROS, L.B. BARICHELLO; An analytical approach for solving a nodal formulation of twodimensional fixed-source neutron transport problems with linearly anisotropic scattering; Progress in Nuclear Energy, 98 (2017), 193-201

COELHO, F. R.; FONSECA, R. J. C.; FRANCA, F. H. R..; Analysis of the effect of high pressure levels on the radiative heat transfer of participating gases; Proceedings of ENCIT 2016, Vitória, 2016

CORMANICH, R. A.; O'HAGAN, D.; BUHL, M.; Hyperconjugation Is the Source of Helicity in Perfluorinated n-Alkanes; Angew.Chem. Int.Ed. 2017, 56,7867 –7870

CORMANICH, R. A.; O'HAGAN, D.; BUHL, D.; Hyperconjugation is the source of helicity in perfluorinated n-alkanes; Angewandte Chemie (Submetido/em revisão)

CORMANICH, R. A.; OHAGAN, D.; BUHL, D.; Hyperconjugation is the source of helicity in perfluorinated n-alkanes; Angewandte Chemie (Submetido/em revisão)

DE AGUIAR, CARLA; COSTA, MAURICIO G.; VERLI, HUGO; Dynamics on human Toll-like receptor 4 complexation to MD-2: the coreceptor stabilizing function; Proteins. 2015 Feb;83(2):373-82. doi: 10.1002/prot.24739. PubMed PMID: 25488602

DE CARVALHO, L. P., DA SILVA, K. F., DOS SANTOS, L. L., DOS SANTOS, M. V. P., SILVA, J. A. B., LONGO, R. L.; Chemoselective oxidation of unsaturated organosulfur, selenium and phosphorus compounds by molybdenum oxodiperoxo complexes: A computational investigation; Inorganica Chimica Acta 467 (2017) 351–357.

DE CARVALHO, L. P., DA SILVA, K. F., DOS SANTOS, L. L., DOS SANTOS, M. V. P., SILVA, J. A. B., LONGO, R. L.; Chemoselective oxidation of unsaturated organosulfur, selenium and phosphorus compounds by molybdenum oxodiperoxo complexes: A computational investigation; Inorganica Chimica Acta 467 (2017) 351–357.

DE OLIVEIRA, T. E., MUKHERJI, DEBASHISH ; KREMER, KURT ; NETZ, PAULO A.; Effects of stereochemistry and copolymerization on the LCST of PNIPAm; The Journal of Chemical Physics, v. 146, p. 034904, 2017

FELIPE S. S. SCHNEIDER, MAXIMILIANO SEGALA, GIOVANNI F. CARAMORI, EDER HENRIQUE DA SILVA, RENATO L. T. PARREIRA & PIET W.N.M. VAN LEEUWEN; How Secondary Phosphine Oxides Interact with Silver Nanoclusters? A Physical Reasoning; Nature Chemistry, submetido

FRANCISCO AZEVEDO; JOVELINE RICHARDT; MAYRLA OLIVEIRA; INES ARAUJO; RICARDO OLIVEIRA; LUIS BAPTISTA; HERMES AMORIM; In Silico Screening and Analysis of Potential Inhibitors of Arylamine N-Acetyltransferases (NATs) from the Traditional Chinese Medicine: A Study Using Free Available Tools; https://www.preprints.org/manuscript/201706.0132/v1

GLAUCIO R. NAGURNIAK, GIOVANNI F. CARAMORI, RENATO L. T. PARREIRA, PEDRO A. S. BERGAMO, GERNOT FRENKING AND ALVARO MUñOZ-CASTRO; Shedding Light on the Nature of Host-Guest Interactions in PAHs-ExBox^4+ Complexes; J. Phys. Chem. C., 2016, 28,120, 15480-15487

GUIMARAES, RICARDO; OLEINIK, PHELYPE; LOPES, BRUNO; MARQUES, WILIAM; ANÁLISE DO POTENCIAL ENERGÉTICO DE ONDA NA PLATAFORMA CONTINENTAL BRASILEIRA; XXIV Congresso Nacional de Estudantes de Engenharia Mecânica

HAMM, JBS, MUNIZ AR, POLLO LD, MARCILIO NR, TESSARO IC.; Experimental and computational analysis of carbon molecular sieve membrane formation upon polyetherimide pyrolysis; Carbon. 119:21-29. 2017

JOANA G. FREIRE, MARCIA R. GALLAS, AND JASON A.C. GALLAS; Stability mosaics in a forced Brusselator: Auto-organization of oscillations in control parameter space; European Physics Journal Special Topics 226, 1987-1995 (2017)

JOANA G. FREIRE, MARCIA R. GALLAS, AND JASON A.C. GALLAS; Nonchaos-mediated mixed-mode oscillations in a prey-predator model ; Chapter in Chaotic, Fractional, and Complex Dynamics: New Insights and Perspectives, Springer Verlag, 2017, in print

JOANA G. FREIRE, MARCIA R. GALLAS, AND JASON A.C. GALLAS; Stability mosaics in a forced Brusselator; Submetido para publicação

JOANA G. FREIRE, MARCIA R. GALLAS, AND JASON A.C. GALLAS; Stability mosaics in a forced Brusselator;; Eur. Phys. J. Special Topics 226, 1987-1995 (2017)

JOANA G. FREIRE; MARCIA R. GALLAS; AND JASON A.C. GALLAS; Chaos-Free Oscillations; EPL, 118 (2017) 38003

JOSE J SUAREZ-VARGAS; C. ABRAHAM T.-CHAVEZ; ANETA STEFANOVSKA; PETER V. E. MCCLINTOCK; Arnold tongues, chaotic phases and oscillation death in a coupled oscillator system; PRE

KONZEN, P.H.A.; AZEVEDO, F.S.; SAUTER, E.; RICHTER, T.; Parallel Iterative Finite Element Procedure with DWR Mesh Adaptation to Simulate Transport Problems in X - Y Geometry; 25th International Conference on Transport Theory, October 16-20, 2017

LINN, R.V.; AWRUCH, A.M.; Edge-based anisotropic mesh adaptation of unstructured meshes with applications to compressible flows; Engineering with Computers, 2017, pp. 1-19.

MARCOS PEREZ; GERARDO MARTINEZ; Entropic Entanglement in the Kitaev chain with non-diagonal disorder; SLAFES 2015

MARCOS PEREZ; GERARDO MARTINEZ; Topological Properties of the Inhomogeneous Kitaev Chain; IIP Natal November 2016

MARTINOTTO, A. L. ; ZORZI, JANETE E ; PEROTTONI, C. A.; Born-Oppenheimer molecular dynamics simulation of pentanoic acid adsorption on α -Al2O3; APPLIED SURFACE SCIENCE, v. 423, p. 780-787, 2017

MARTINOTTO, A. L.; ZORZI, J. E.; PEROTTONI, C. A.; Born-Oppenheimer Molecular Dynamics Simulation of Pentanoic Acid Adsorption on α-Al2O3; Applied Surface Science (aceito para publicação)

MARTINOTTO, ANDRE L. ; ZORZI, JANETE E.; PEROTTONI, CLAUDIO A.; Born-Oppenheimer Molecular Dynamics Simulation of Pentanoic Acid Adsorption on Al2O3; APPLIED SURFACE SCIENCE, v. 1, p. 1, 2017

MAXIMILIANO SEGALA, FELIPE S. S. SCHNEIDER, GIOVANNI F. CARAMORI, AND RENATO L. T. PARREIRA; Evaluation of Electron Donation as a Mechanism for the Stabilisation of Chalcogenate-Protected Gold Nanoclusters; ChemPhysChem 2016, 17, 3102

M. CASTANEDA; M. GUSMAO; TEXEIRA S.; Surface Electronic Properties of Ta3N5 with 110 Orientation with Doping Zr and Mg; Dissertacao de Doutorado em andamento

MEIRELES, MARIANA; PANTOJA, ANDERSON; ORNAGHI, ANA PAULA; VIEIRA, GUSTAVO; SALZANO, FRANCISCO; BANDINELLI, ELIANE; Molecular characterization of haemophilia B patients in southern Brazil; Haemophilia (accepted for publication)

MEUCCI, R. ; EUZZOR, S. ; PUGLIESE, E. ; ZAMBRANO, S. ; GALLAS, M.R. ; GALLAS, J.A.C.; Optimal Phase-Control Strategy for Damped-Driven Duffing Oscillators; Physical Review Letters, v. 116, p. 044101, 2016

MONCALVES, MATIAS; ZANOTTO, GABRIEL M.; TOLDO, JOSENE M.; RAMPON, DANIEL S.; SCHNEIDER, PAULO H.; GONCALVES, PAULO F. B.; RODEMBUSCH, FABIANO S.; SILVEIRA; CLAUDIO C.; Dipolar vinyl sulfur fluorescent dyes. Synthesis and photophysics of sulfide, sulfoxide and sulfone based D–p–A compounds; RSC Adv., 2017, 7, 8832

MONTEIRO, CAROLINE BARBOSA; KIRINUS, EDUARDO DE PAULA; MARQUES, WILIAM CORREA; OLEINIK, PHELYPE HARON; COSTI, JULIANA; Analysis of Two Oil Spills in the Southern Brazilian Shelf, in the Years of 2012 and 2014; Defect and Diffusion Forum, vol. 372, pp. 70-80, 2017. DOI: 10.4028/www.scientific.net/DDF.372.70

OLEINIK, PHELYPE HARON; MARQUES, WILIAM CORREA; KIRINUS, EDUARDO DE PAULA; Estimate of the Wave Climate on the Most Energetic Locations of the South-Southeastern Brazilian Shelf; Defect and Diffusion Forum, Vol. 370, pp 130-140, 2017.

OLEINIK, PHELYPE HARON; MARQUES, WILIAM CORREA; KIRINUS, EDUARDO DE PAULA; Evaluation of the Seasonal Pattern of Wind-Driven Waves on the South-Southeastern Brazilian Shelf; Defect and Diffusion Forum, Vol. 370, pp 130-140, 2017.

PADUANI, C; A DFT study on the hydrogen desorption from the lithium borohydride; Internation J of Hydrogen Energy

PADUANI, C., RAPPE, A.M. ; PADUANI, C., RAPPE, A.M.; Design of New Complexes of Inorganic Salts Based on Lithium and Magnesium Hydroxides and Carbonates for Usage as Propellants and Flame Retardants; Journal of Physical Chemistry A, 120 (39), 2016, pp. 7764-7770

PAPALEO, RICARDO M.; THOMAZ RAQUEL; TRAUTMANN C.; HOFF GABRIELA; PIREAUX J.-J. , AND GUTIERRES LEANDRO; Effect of Spatial Confinement on the Radiolytic Efficiency of High-Energy Ions in Polymers; International Conference on Applications of Radiation Science and Technology (ICARST-2017)

POL-FACHIN, L.; Insights into the effects of glycosylation and the monosaccharide-binding activity of the plant lectin CrataBL; Glycoconjugate Journal, DOI 10.1007/s10719-017-9766-7

PRUDENTE, FREDERICO V.; MARQUES, J. M. C.; PEREIRA, F. B.; Solvation of Li+ by argon: how important are three-body forces?; Phys. Chem. Chem. Phys, 2017, 19, 25707

ROCHA, RF; CANTO, VP; SILVEIRA, GP; NETZ, PA.; Inhibitors of salicylic acid binding protein (SABP2) study through docking and molecular dynamics approach; Book of 46th World Chemistry Congress & 40ª Reunião Anual da Sociedade Brasileira de Química, São Paulo, 2017

ROCHA, RF; CANTO, VP; SILVEIRA, GP; NETZ, PA.; Estudo Teórico de derivados do ácido salicílico como inibidores da proteína de ligação ao ácido salicílico-2 (SABP2); Livro de resumos do XXIII Encontro de Química da Região Sul, Santa Maria, 2016

SILVEIRA, JFRV, MUNIZ AR.; Functionalized diamond nanothreads from benzene derivatives.; Physical Chemistry Chemical Physics. 19:7132-7137. 2017.

SILVEIRA, JFRV, MUNIZ AR.; First-principles calculation of the mechanical properties of diamond nanothreads; Carbon. 113:260-265. 2017

SILVEIRA, JULIAN F.R.V. ; MUNIZ, ANDRE R. ; First-principles calculation of the mechanical properties of diamond nanothreads.; Carbon , v. 113, p. 260-265, 2017

THAIS CHAGAS, THIAGO H. R. CUNHA, MATHEUS J. S. MATOS, DIOGO D. DOS REIS, KAROLLINE A. S. ARAUJO, ANGELO MALACHIAS, MARIO S. C. MAZZONI, ANDRE S. FERLAUTO AND ROGERIO MAGALHAES-PANIAGO; Room temperature observation of the correlation between atomic and electronic structure of graphene on Cu(110); RSC Adv., 2016,6, 98001-98009

TOLDO, JOSENE; BARBATTI, MARIO; GONCALVES, PAULO; A three-state model for the photo-Fries rearrangement; Phys. Chem. Chem. Phys., 2017

TONIN, MATEUS GUIMARAES; Análise Isogeométrica Aplicada à Problemas de Interação Fluido-Estrutura e Superfície Livre; Porto Alegre, 2017, 178

VLADIMIR ALANES; C. ABRAHAM T.-CHAVEZ; Tricorn structures in a semiconductor laser subject to optical injection; Optics Communications