| Chemoface: a novel free user-friendly interface for chemometrics CA Nunes, MP Freitas, ACM Pinheiro, SC Bastos Journal of the Brazilian Chemical Society 23, 2003-2010, 2012 | 309 | 2012 |
| Prediction of drug dissolution profiles from tablets using NIR diffuse reflectance spectroscopy: a rapid and nondestructive method MP Freitas, A Sabadin, LM Silva, FM Giannotti, DA do Couto, E Tonhi, ... Journal of pharmaceutical and biomedical analysis 39 (1-2), 17-21, 2005 | 110 | 2005 |
| MIA-QSAR: a simple 2D image-based approach for quantitative structure–activity relationship analysis MP Freitas, SD Brown, JA Martins Journal of molecular structure 738 (1-3), 149-154, 2005 | 105 | 2005 |
| Lycopersicon esculentum submitted to Cd-stressful conditions in nutrition solution: nutrient contents and translocation AC Bertoli, MG Cannata, R Carvalho, ARR Bastos, MP Freitas, ... Ecotoxicology and environmental safety 86, 176-181, 2012 | 90 | 2012 |
| Ant colony optimization as a feature selection method in the QSAR modeling of anti-HIV-1 activities of 3-(3, 5-dimethylbenzyl) uracil derivatives using MLR, PLS and SVM regressions M Goodarzi, MP Freitas, R Jensen Chemometrics and intelligent laboratory systems 98 (2), 123-129, 2009 | 88 | 2009 |
| The anomeric effect on the basis of natural bond orbital analysis MP Freitas Organic & biomolecular chemistry 11 (17), 2885-2890, 2013 | 87 | 2013 |
| MIA-QSAR modelling of anti-HIV-1 activities of some 2-amino-6-arylsulfonylbenzonitriles and their thio and sulfinyl congeners MP Freitas Organic & Biomolecular Chemistry 4 (6), 1154-1159, 2006 | 77 | 2006 |
| Feature selection and linear/nonlinear regression methods for the accurate prediction of glycogen synthase kinase-3Β inhibitory activities M Goodarzi, MP Freitas, R Jensen Journal of chemical information and modeling 49 (4), 824-832, 2009 | 73 | 2009 |
| The search for new COX-2 inhibitors: a review of 2002–2008 patents TC Ramalho, MVJ Rocha, EFF da Cunha, MP Freitas Expert opinion on therapeutic patents 19 (9), 1193-1228, 2009 | 59 | 2009 |
| 1hJFH coupling in 2‐fluorophenol revisited: Is intramolecular hydrogen bond responsible for this long‐range coupling? RA Cormanich, MA Moreira, MP Freitas, TC Ramalho, CPA Anconi, ... Magnetic Resonance in Chemistry 49 (12), 763-767, 2011 | 54 | 2011 |
| Conformational analysis of 2-halocyclohexanones: an NMR, theoretical and solvation study F Yoshinaga, CF Tormena, MP Freitas, R Rittner, RJ Abraham Journal of the Chemical Society, Perkin Transactions 2, 1494-1498, 2002 | 53 | 2002 |
| The F⋯ HO intramolecular hydrogen bond forming five-membered rings hardly appear in monocyclic organofluorine compounds RA Cormanich, MP Freitas, CF Tormena, R Rittner RSC advances 2 (10), 4169-4174, 2012 | 52 | 2012 |
| MIA–QSAR coupled to principal component analysis-adaptive neuro-fuzzy inference systems (PCA–ANFIS) for the modeling of the anti-HIV reverse transcriptase activities of TIBO … M Goodarzi, MP Freitas European journal of medicinal chemistry 45 (4), 1352-1358, 2010 | 45 | 2010 |
| pKa modeling and prediction of a series of pH indicators through genetic algorithm-least square support vector regression M Goodarzi, MP Freitas, CH Wu, PR Duchowicz Chemometrics and Intelligent Laboratory Systems 101 (2), 102-109, 2010 | 44 | 2010 |
| Structural determination of Zn and Cd–DTPA complexes: MS, infrared, 13C NMR and theoretical investigation VL Silva, R Carvalho, MP Freitas, CF Tormena, WC Melo Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 68 (5 …, 2007 | 44 | 2007 |
| Novel anti-HIV cyclotriazadisulfonamide derivatives as modeled by ligand-and receptor-based approaches JR Pinheiro, M Bitencourt, EFF da Cunha, TC Ramalho, MP Freitas Bioorganic & medicinal chemistry 16 (4), 1683-1690, 2008 | 43 | 2008 |
| QSPR predictions of heat of fusion of organic compounds using Bayesian regularized artificial neural networks M Goodarzi, T Chen, MP Freitas Chemometrics and Intelligent Laboratory Systems 104 (2), 260-264, 2010 | 40 | 2010 |
| Predicting Boiling Points of Aliphatic Alcohols through Multivariate Image Analysis Applied to Quantitative Structure− Property Relationships M Goodarzi, MP Freitas The Journal of Physical Chemistry A 112 (44), 11263-11265, 2008 | 39 | 2008 |
| Computational analysis and physico-chemical characterization of an inclusion compound between praziquantel and methyl-β-cyclodextrin for use as an alternative in the treatment … SG Rodrigues, IS Chaves, NFS de Melo, MB de Jesus, LF Fraceto, ... Journal of Inclusion Phenomena and Macrocyclic Chemistry 70, 19-28, 2011 | 38 | 2011 |
| Spectrometric and theoretical investigation of the structures of Cu and Pb/DTPA complexes VL Silva, R Carvalho, MP Freitas, CF Tormena, WC Melo Structural Chemistry 18, 605-609, 2007 | 38 | 2007 |
