Browsing by Author Kiralj, R

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Showing results 1 to 16 of 16
PreviewIssue DateTitleAuthor(s)AdvisorType
2009Critical comparative analysis, validation and interpretation of SVM and PLS regression models in a QSAR study on HIV-1 protease inhibitorsHernandez, N; Kiralj, R; Ferreira, MMC; Talavera, I-Artigo de periódico
2010Is your QSAR/QSPR descriptor real or trash?Kiralj, R; Ferreira, MMC-Artigo de periódico
2008Extensive chemometric investigations of the multidrug resistance in strains of the phytopathogenic fungus Penicillium digitatumKiralj, R; Ferreira, MMC-Artigo de periódico
2008Comparative chemometric and QSAR/SAR study of structurally unrelated substrates of a MATE efflux pump VmrA from V. parahaemolyticus: Prediction of multidrug resistanceKiralj, R; Ferreira, MMC-Artigo de periódico
2008QSPR study of passivation by phenolic compounds at platinum and boron-doped diamond electrodesTeofilo, RF; Kiralj, R; Ceragioli, HJ; Peterlevitz, AC; Baranauskas, V; Kubota, LT; Ferreira, MMC-Artigo de periódico
2003QSAR of progestogens: Use of a priori and computed molecular descriptors and molecular graphicsKiralj, R; Takahata, Y; Ferreira, MMC-Artigo de periódico
2004QSAR study of beta-lactam antibiotic efflux by the bacterial multidrug resistance pump AcrBFerreira, MMC; Kiralj, R-Artigo de periódico
2008Theoretical study of radical and neutral intermediates of artemisinin decompositionPereira, MSC; Kiralj, R; Ferreira, MMC-Artigo de periódico
2006Chemometric modeling of core-electron binding energiesKiralj, R; Takahata, Y-Artigo de periódico
2008Simple quantitative structure-property relationship (QSPR) Modeling of O-17 carbonyl chemical shifts in substituted benzaldehydes compared to DFT and empirical approachesKiralj, R; Ferreira, MMC-Artigo de periódico
-Predicting Bond Lengths In Planar Benzenoid Polycyclic Aromatic Hydrocarbons: A Chemometric Approach.Kiralj, R; Ferreira, M M C-Artigo de periódico
-On Heteroaromaticity Of Nucleobases. Bond Lengths As Multidimensional Phenomena.Kiralj, R; Ferreira, M M C-Artigo de periódico
2008A Priori Descriptors in QSAR: a Case of Gram-Negative Bacterial Multidrug Resistance to beta-LactamsKiralj, R; Ferreira, MMC-Artigo de periódico
2003Artemisinin derivatives with antimalarial activity against Plasmodium falciparum designed with the aid of quantum chemical and partial least squares methodsPinheiro, JC; Kiralj, R; Ferreira, MMC; Romero, OAS-Artigo de periódico
2009Basic Validation Procedures for Regression Models in QSAR and QSPR Studies: Theory and ApplicationKiralj, R; Ferreira, MMC-Artigo de periódico
-Chemometric Analysis Of The Multidrug Resistance In Strains Of Penicillium Digitatum.Kiralj, R; Ferreira, M M C-Artigo de periódico