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Coleção's Items (Ordenado por Data de depósito na Descendente ordem): 401 para 420 de 1221
Data do documentoTítuloAutor(es)
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.
Set-2012MIA-QSAR modeling of the anti-HIV-1 protease activities and cytotoxicities of Ritonavir analoguesG. Silva, Daniel; P. Freitas, Matheus
Ago-2012Density functional study of the one-bond C-F coupling constant in a-fluorocarbonyl and a-fluorosulfonyl compoundsFreitas, Matheus P.; Bühl, Michael
Mar-2012F...HO intramolecular hydrogen bond forming five-membered rings hardly appears in monocyclic organofluorine compoundsCormanich, Rodrigo A.; Freitas, Matheus P.; Tormena, Cláudio F.; Rittner, Roberto
Jan-2012Stereoelectronic interactions and the one-bond C-F coupling constant in sevofluraneFreitas, Matheus P.; Bühl, Michael; O’Hagan, David; Cormanich, Rodrigo A.; Tormena, Cláudio F.
Jan-20121,2-Difluoroethane: the angular dependance on 1JCF coupling constants is independent of hyperconjugationFreitas, Matheus P.; Bühlb, Michael; O'Hagan, David
2011Spectroscopy: a tool for conformational analysisTormena, Cláudio F.; Cormanich, Rodrigo A.; Rittner, Roberto
Jul-2011Alkyl group effect on the conformational isomerism of trans-2-bromo-alkoxycyclohexanes analyzed by NMR spectroscopy and theoretical calculationsSilla, Josué M.; Cormanich, Rodrigo A.; Duarte, Claudimar J.; Freitas, Matheus P.; Ramalho, Teodorico C.; Barbosa, Thaís M.; Santos, Francisco P.; Tormena, Cláudio F.; Rittner, Roberto
2011MIA-QSAR coupled to different regression methods for the modeling of antimalarial activities of 2-aziridinyl and 2,3-bis-(aziridinyl)-1,4-naphtoquinonyl sulfate and acylate derivativesGoodarzi, Mohammad; Freitas, Matheus P.
Set-2011Theoretical and infrared spectroscopy study of the conformational preferences for some 3-Monosubstituted-2-MethylpropenesSchuquel, I. T. A.; Pontes, R. M.; Freitas, M. P.; Rittner, R.
Out-2011Linear and nonlinear QSAR modeling of the HIV-1 reverse transcriptase inhibiting activities of thiocarbamatesGoodarzi, Mohammad; Freitas, Matheus P.; Heyden, Yvan Vander
-2D chemical drawings correlate to bioactivities: MIA-QSAR modelling of antimalarial activities of 2,5-diaminobenzophenone derivativesCormanich, Rodrigo A.; Freitas, Matheus P.; Rittner, Roberto
Mar-2011Conformational analysis and intramolecular interactions in 2-haloethanols and their methyl ethersSouza, Felipe R.; Freitas, Matheus P.
Dez-2010QSPR predictions of heat of fusion of organic compounds using bayesian regularized artificial neural networksGoodarzi, Mohammad; Chen, Tao; Freitas, Matheus P.
Set-2010QSAR studies of bioactivities of 1-(azacyclyl)-3-arylsulfonyl-1H-pyrrolo[2,3-b]pyridines as 5-HT6 receptor ligands using physicochemical descriptors and MLR and ANN-modelingGoodarzi, Mohammad; Freitas, Matheus P.; Ghasemi, Nahid
Nov-2010PLS and N-PLS-based MIA-QSTR modeling of the acute toxicities of phenylsulfonyl carboxylates to Vibrio fischeriGoodarzi, Mohammad; Freitas, Matheus P.
Out-2010MIA-QSAR, PC-Ranking and least-squares support-vector machines in the accurate prediction of the activities of Phosphodiesterase Type 5 (PDE-5) inhibitorsGoodarzi, Mohammad; Freitas, Matheus P.
Jun-2010Prediction of the Hildebrand parameter of various solvents using linear and nonlinear approachesGoodarzi, Mohammad; Duchowicz, Pablo R.; Freitas, Matheus P.; Fernández, Francisco M.
Abr-2010pKa modeling and prediction of a series of pH indicators through genetic algorithm-least square support vector regressionGoodarzi, Mohammad; Freitas, Matheus P.; Wu, Chih H.; Duchowicz, Pablo R.
2010Em busca da conservação ambiental: a contribuição da percepção ambiental para a formação e atuação dos profissionais da químicaFreitas, Mirlaine R.; Macedo, Renato L. G.; Ferreira, Eric B.; Freitas, Matheus P.
Coleção's Items (Ordenado por Data de depósito na Descendente ordem): 401 para 420 de 1221