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Out-2013Conformational analysis of 1-chloro- and 1-bromo-2-propanolGonçalves, Karla M. S.; Garcia, Danielle R.; Ramalho, Teodorico C.; Figueroa-Villar, José D.; Freitas, Matheus P.
16-Abr-2014Conformational analysis of 2,2-difluoroethylamine hydrochloride: double gauche effectSilla, Josué M.; Duarte, Claudimar J.; Cormanich, Rodrigo A.; Rittner, Roberto; Freitas, Matheus P.
2-Out-2013Conformational analysis of 6-fluorosalicylic acidSilla, Josué M.; Duarte, Claudimar J.; Rittner, Roberto; Freitas, Matheus P.
5-Dez-2021Conformational analysis of halobenzaldehydes: a theoretical and spectroscopic studyFernandes, Débora da S. M.; Lago, Aline de F. S.; Thomasi, Sérgio S.; Freitas, Matheus P.
Ago-2012Conformational analysis, stereoelectronic interactions and NMR properties of 2-fluorobicyclo[2.2.1]heptan-7-olsRezende, Fátima M. P. de; Moreira, Marilua A.; Cormanich, Rodrigo A.; Freitas, Matheus P.
Jun-2021Conformational and substituent effects on the rehybridization of boron in β-substituted ethylboranesMartins, Francisco A.; Freitas, Matheus P.
Out-2015Conformational exploration of enflurane in solution and in a biological environmentAndrade, Laize A. F.; Silla, Josué M.; Stephens, Susanna L.; Marat, Kirk; Cunha, Elaine F. F. da; Ramalho, Teodorico C.; van Wijngaarden, Jennifer; Freitas, Matheus P.
2020Conformational fingerprints in the modelling performance of MIA-QSAR: a case for SARS-CoV protease inhibitorsDaré, Joyce K.; Silva, Daniela R.; Ramalho, Teodorico C.; Freitas, Matheus P.
24-Ago-2017Conformational impact of structural modifications in 2-fluorocyclohexanoneMartins, Francisco A.; Silla, Josué M.; Freitas, Matheus P.
Out-2020Conformational preferences of fluorine-containing agrochemicals and their implications for lipophilicity predictionSilva, Daniela Rodrigues; Daré, Joyce K.; Freitas, Matheus P.
2019Conformational signature of Ishikawa´s reagent using NMR information from diastereotopic fluorinesAndrade, Laize A. F.; Zeoly, Lucas A.; Cormanich, Rodrigo A.; Freitas, Matheus P.
Ago-2012Density functional study of the one-bond C-F coupling constant in a-fluorocarbonyl and a-fluorosulfonyl compoundsFreitas, Matheus P.; Bühl, Michael
2010Description of the acid/base behavior of organic phosphines using ab initio and chemometric approachesSantiago, Regis T.; La Porta, Felipe A.; Rocha, Marcus V. J.; Ramalho, Teodorico C.; Freitas, Matheus P.; Cunha, Elaine F. F. da
Abr-2015DFT study of the 1JC-F coupling constant in X-CHF-X fragments (X = O and S)Silla, Josué M.; Freitas, Matheus P.
Dez-2017DFT study on the complexation of anions with 1,4,7,10,13,16-hexaazacyclooctodeca-2,5,8,11,14,17-hexaeneAndrade, Laize A. F.; Silla, Josué M.; Mendonça, João Guilherme P.; Freitas, Matheus P.
15-Mai-2021Different approaches to encode and model 3D information in a MIA-QSAR perspectiveDaré, Joyce K.; Freitas, Matheus P.
1-Set-2021Dipolar repulsion in α-halocarbonyl compounds revisitedSilva, Daniela Rodrigues; Santos, Lucas de Azevedo; Hamlin, Trevor A.; Bickelhaupt, F. Matthias; Freitas, Matheus P.; Guerra, Célia Fonseca
2018Discrete fourier transform based multivariate image analysis: application to modeling aromatase inhibitory activityBarigye, Stephen J.; Freitas, Matheus P.; Ausina, Priscila; Zancan, Patricia; Sola-Penna, Mauro; Castillo-Garit, Juan A.
2019Does induced current density explain the C–H and C–F Perlin effects?Martins, Francisco A.; Pires, Felipe C.; Cunha, Elaine F. F. da; Freitas, Matheus P.
19-Set-2014Does intramolecular hydrogen bond play a key role in the stereochemistry of α- and β-d-glucose?Silla, Josué M.; Cormanich, Rodrigo A.; Rittner, Roberto; Freitas, Matheus P.