2015
| Metal coordination study at Ag and Cd sites in crown thioether complexes through DFT calculations and hyperfine parameters
Rafael R. do Nascimento, Filipe C. D. A. Lima, Marcos B. Gonçalves, Leonardo A. Errico, Mario Rentería and Helena M. Petrilli. J. Mol. Model. 21, 97 (1-7), (2015) Fulltext: [doi] |
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| Polarized emission from stretched PPV films viewed at the molecular level
Rodrigo Ramos, Melissa F. Siqueira, Thiago Cazati, Roberto M. Faria and Marilia J. Caldas. Phys. Chem. Chem. Phys 17, 20530 (2015) Fulltext: [doi] |
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| Delivery system for mefenamic acid based on the nanocarrier layered double hydroxide: Physicochemical characterization and evaluation of anti-inflammatory and antinociceptive potential
Vanessa R.R. Cunha, Viviane A. Guilherme, Eneida de Paula, Daniel R. de Araujo, Renan O. Silva, Jand V. R. Medeiros, José R. S. A. Leite, Philippe A. D. Petersen, Marianna Foldvari, Helena M. Petrilli, Vera R. L. Constantino. Materials Science and Engineering C 58 629-638 (2016) (print on line in 2015) Fulltext: [doi] |
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| Thermodynamic modelling of the Nb-Ni-Si phase diagram based on the 1073 K isothermal section using ab initio calculations
Vinicius O. dos Santos, Helena M. Petrilli, Cláudio H. Schön, Luiz T. F. Eleno. Calphad 51, 57-66 (2015) Fulltext: [doi] |
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| Inhibition of cyclin-dependent kinase CDK1 by oxindolimine ligands and corresponding copper and zinc complexes
Rodrigo Bernardi Miguel, Philippe Alexandre Divina Petersen, Fernando A. Gonzales-Zubiate, Carla Columbano Oliveira, Naresh Kumar, Rafael Rodrigues do Nascimento, Helena Maria Petrilli and Ana Maria da Costa Ferreira. J. Bio. Inorg. Chem v. 20 p. 1205-1217, (2015) Fulltext: [doi] |
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| Leght dependence of ionization potentials of transacetylenes: Internally consistent DFT/GW approach
Max Pinheiro Jr, Marilia J. Caldas, Patrick Rinke, Volker Blum and Matthias Scheffler. Phys. Rev. B 92 195134 (2015). Fulltext: [doi] |