| Desirability-based methods of multiobjective optimization and ranking for global QSAR studies. Filtering safe and potent drug candidates from combinatorial libraries M Cruz-Monteagudo, F Borges, MNDS Cordeiro, JL Cagide Fajin, ... Journal of Combinatorial Chemistry 10 (6), 897-913, 2008 | 55 | 2008 |
| An approach to identify new antihypertensive agents using Thermolysin as model: In silico study based on QSARINS and docking Y Canizares-Carmenate, K Mena-Ulecia, Y Perera-Sardiña, F Torrens, ... Arabian Journal of Chemistry 12 (8), 4861-4877, 2019 | 35 | 2019 |
| Prediction of Caco-2 cell permeability using bilinear indices and multiple linear regression H Le-Thi-Thu, Y Canizares-Carmenate, Y Marrero-Ponce, F Torrens, ... Letters in Drug Design & Discovery 13 (2), 161-169, 2016 | 18 | 2016 |
| Prediction of ADME properties, Part 1: Classification models to predict Caco-2 cell permeability using atom-based bilinear indices J Castillo-Garit, Y Cañizares-Carmenate, Y Marrero-Ponce, C Abad, ... Afinidad 71 (566), 2014 | 13 | 2014 |
| Larvicidal activity prediction against Aedes aegypti mosquito using computational tools Y Canizares-Carmenate, M Hernandez-Morfa, F Torrens, G Castellano, ... Journal of vector borne diseases 54 (2), 164-171, 2017 | 10 | 2017 |
| Thorough evaluation of OECD principles in modelling of 1-[(2-hydroxyethoxy) methyl]-6-(phenylthio) thymine derivatives using QSARINS Y Cañizares-Carmenate, LE Campos Delgado, F Torrens, ... SAR and QSAR in Environmental Research 31 (10), 741-759, 2020 | 8 | 2020 |
| Machine learning approach to discovery of small molecules with potential inhibitory action against vasoactive metalloproteases Y Canizares-Carmenate, K Mena-Ulecia, D MacLeod Carey, ... Molecular Diversity 26 (3), 1383-1397, 2022 | 7 | 2022 |
| Pham-The, H.; Pérez-Doñate, V.; Torrens, F.; Pérez-Giménez, F. A Review of Computational Approaches Targeting SARS-CoV-2 Main Protease to the Discovery of New Potential … JA Castillo-Garit, Y Cañizares-Carmenate Curr. Top. Med. Chem 23, 3-16, 2023 | 5 | 2023 |
| Ligand-based discovery of new potential acetylcholinesterase inhibitors for Alzheimer’s disease treatment Y Cañizares-Carmenate, NH Nam, R Díaz-Amador, NT Thuan, PTP Dung, ... SAR and QSAR in Environmental Research 33 (1), 49-61, 2022 | 4 | 2022 |
| A review of computational approaches targeting SARS-CoV-2 main protease to the discovery of new potential antiviral compounds JA Castillo-Garit, Y Cañizares-Carmenate, V Pérez-Doñate, F Torrens, ... Current Topics in Medicinal Chemistry 23 (1), 3-16, 2023 | 3 | 2023 |
| Biosynthetic enzymes of the SARS-CoV-2 as potential targets for the discovery of new antiviral drugs JA Castillo-Garit, Y Cañizares-Carmenate, F Pérez-Giménez Nereis. Interdisciplinary Ibero-American Journal of Methods, Modelling and …, 2021 | 3 | 2021 |
| Computational modeling of aldose reductase inhibitory activity of flavonoids derivatives for diabetic complications treatment R Díaz-Amador, Y Cañizares-Carmenate, A Taboada-Crispi, ... Letters in Drug Design & Discovery 18 (11), 1094-1105, 2021 | 1 | 2021 |
| In silico identification of Jatopha gossypifolia L. flavonoids as aldose reductase inhibitors in diabetes mellitus. Y Cañizares-Carmenate, NTT Quang, ÁAD León, MMG Bedia, ... MOL2NET-06 International Conference on Multidisciplinary Sciences, 2020 | 1 | 2020 |
| Computational approach to the discovery of potential neprilysin inhibitors compounds for cardiovascular diseases treatment Y Cañizares-Carmenate, A Alcántara Cárdenas, V Roche Llerena, ... Medicinal Chemistry Research 29, 897-909, 2020 | 1 | 2020 |
| Characterizing airway obstruction syndrome in preterm neonates: A neonatology service study S Rivero-Morales, N Rodriguez-Guevara, OC Aríz-Milian, ... Journal of Neonatal Nursing, 2024 | | 2024 |
| Ligand and structure-based discovery of phosphorus-containing compounds as potential metalloproteinase inhibitors Y Cañizares-Carmenate, Y Perera-Sardiña, Y Marrero-Ponce, ... SAR and QSAR in Environmental Research, 1-22, 2024 | | 2024 |
| INTEGRAL EVALUATION OF NEUTRAL ENDOPEPTIDASE INHIBITORS AS POSSIBLE ANTIHYPERTENSIVE AGENTS BY MEANS MOLECULAR MECHANICS, FREE ENERGY CALCULATION AND ADME-TOX PROPERTIES JA Castillo-Garit, E Lamazares, Y Cañizares-Carmenate, K Mena-Ulecia Journal of the Chilean Chemical Society 68 (3), 5904-5910, 2023 | | 2023 |
| Virtual screening of flavonoids from Jatropha gossypiifolia L. as potential drugs for diabetic complications Y Cañizares-Carmenate, R Díaz-Amador, MM Gonzalez-Bedia, TTQ Nhat, ... Tradit Med Res 7 (2), 14, 2022 | | 2022 |
| QSARINS Based Computational Identification of Sars-Cov-2 Main Protease Inhibitors J Castillo-Garit, Y Cañizares-Carmenate, F Torrens, F Pérez-Giménez MDPI, 2021 | | 2021 |
| Aplicaciones y potencialidades de los métodos de diseño computacional en estudios ambientales y farmacocinéticos JA Castillo-Garit, H González-Díaz, Y Cañizares-Carmenate, F Torrens, ... Anales de la Academia de Ciencias de Cuba 11 (1), 2021 | | 2021 |
Yovani Marrero-PonceUniversidad San Francisco de Quito (USFQ), Quito, Ecuador; Fundación Universitaria Tecnológico deVerified email at usfq.edu.ec
