Bond-based linear indices in QSAR: computational discovery of novel anti-trichomonal compounds Y Marrero-Ponce, A Meneses-Marcel, OM Rivera-Borroto, ... Journal of Computer-Aided Molecular Design 22, 523-540, 2008 | 47 | 2008 |
Comparison of combinatorial clustering methods on pharmacological data sets represented by machine learning-selected real molecular descriptors OM Rivera-Borroto, Y Marrero-Ponce, JM García-de la Vega, ... Journal of chemical information and modeling 51 (12), 3036-3049, 2011 | 30 | 2011 |
N-linear algebraic maps for chemical structure codification: a suitable generalization for atom-pair approaches? C R Garcia-Jacas, Y Marrero-Ponce, S J Barigye, J R Valdes-Martini, ... Current Drug Metabolism 15 (4), 441-469, 2014 | 28 | 2014 |
Dunn’s index for cluster tendency assessment of pharmacological data sets OM Rivera-Borroto, M Rabassa-Gutiérrez, RC Grau-Ábalo, ... Canadian Journal of physiology and pharmacology 90 (4), 425-433, 2012 | 28 | 2012 |
New antitrichomonal drug-like chemicals selected by bond (edge)-based TOMOCOMD-CARDD descriptors A Meneses-Marcel, OM Rivera-Borroto, Y Marrero-Ponce, A Montero, ... Journal of biomolecular screening 13 (8), 785-794, 2008 | 25 | 2008 |
Discovery of Novel Trichomonacidals Using LDA‐Driven QSAR Models and Bond‐Based Bilinear Indices as Molecular Descriptors OM Rivera‐Borroto, Y Marrero‐Ponce, A Meneses‐Marcel, JA Escario, ... QSAR & Combinatorial Science 28 (1), 9-26, 2009 | 23 | 2009 |
Optimum search strategies or novel 3D molecular descriptors: is there a stalemate? Y Marrero-Ponce, C R Garcia-Jacas, S J Barigye, J R Valdés-Martiní, ... Current Bioinformatics 10 (5), 533-564, 2015 | 21 | 2015 |
Pham-The, H.; Le-Thi-Thu, H.; Rasulev, B.; Casañola-Martin, GM Beyond model interpretability using LDA and decision trees for α-amylase and α-glucosidase inhibitor … K Diéguez-Santana, OM Rivera-Borroto, A Puris Chemical Biology & Drug Design 10, 2019 | 14 | 2019 |
A two QSAR way for antidiabetic agents targeting using α-amylase and α-glucosidase inhibitors: model parameters settings in artificial intelligence techniques K Dieguez-Santana, H Pham-The, O M. Rivera-Borroto, A Puris, ... Letters in Drug Design & Discovery 14 (8), 862-868, 2017 | 14 | 2017 |
Beyond model interpretability using LDA and decision trees for α‐amylase and α‐glucosidase inhibitor classification studies K Diéguez‐Santana, OM Rivera‐Borroto, A Puris, H Pham‐The, ... Chemical biology & drug design 94 (1), 1414-1421, 2019 | 13 | 2019 |
Relational agreement measures for similarity searching of cheminformatic data sets OM Rivera-Borroto, JM García-de la Vega, Y Marrero-Ponce, R Grau IEEE/ACM Transactions on Computational Biology and Bioinformatics 13 (1 …, 2015 | 12 | 2015 |
Exploring the QSAR’s predictive truthfulness of the novel N-tuple discrete derivative indices on benchmark datasets O Martínez-Santiago, Y Marrero-Ponce, R Vivas-Reyes, ... SAR and QSAR in Environmental Research 28 (5), 367-389, 2017 | 9 | 2017 |
Valoración del desempeño de un dispositivo de autoalimentación diseñado para la evaluación operativa de electrodos revestidos A García Rodríguez, CR Gómez Pérez, JV Miguel Oria, ... Soldagem & Inspeção 14, 58-65, 2009 | 8 | 2009 |
Comportamiento del tiempo de duración, la frecuencia de los cortocircuitos y la conductividad eléctrica durante el reencendido del arco en la soldadura SMAW (AC) con electrodos … A García Rodríguez, CR Gómez Pérez, OM Rivera Borroto, ... Soldagem & Inspeção 14, 66-73, 2009 | 4 | 2009 |
Perspectiva general sobre el proceso de desarrollo de fármacos y las técnicas de cribado virtual basadas en la similitud molecular ÓMR Borroto, YH Díaz, JMG de la Vega, R Grau, YM Ponce, ... Anales de la Real Academia Nacional de Farmacia 79 (4), 2013 | 3 | 2013 |
Behaviour of short-circuit frequency and duration time and electrical conductivity during arc re-ignition in SMAW (AC) with E6013 electrodes AG Rodríguez, CRG Pérez, OMR Borroto, JVM Oria Welding International 24 (9), 673-679, 2010 | 3 | 2010 |
La conductividad como herramienta para evaluar el funcionamiento del proceso de lavado en cama móvil LR Machín, B Hoffner, W Stahl, OMR Borroto Afinidad 65 (538), 2008 | 3 | 2008 |
A fuzzy system classification approach for QSAR modeling of α-amylase and α-Glucosidase Inhibitors K Diéguez-Santana, A Puris, OM Rivera-Borroto, GM Casanola-Martin, ... Current Computer-Aided Drug Design 18 (7), 469-479, 2022 | 2 | 2022 |
Theoretical advances on coefficients of relational agreement: application to cheminformatics as k‐way biomolecular similarity measures OM Rivera‐Borroto, JM García‐de la Vega, Y Hernández‐Díaz Journal of Chemometrics 27 (11), 420-430, 2013 | 2 | 2013 |
Novel similarity measures for the effective and efficient retrieval of pharmacological data sets OM Rivera Borroto, Y Hernández Díaz, JM García de la Vega, G Ábalo, ... Afinidad: Revista de química teórica y aplicada 68 (551), 50-56, 2011 | 2* | 2011 |