Efficient production of biodiesel by using a highly active calcium oxide prepared in presence of pectin as heterogeneous catalyst PI Acosta, RR Campedelli, EL Correa, HAG Bazani, EN Nishida, ... Fuel 271, 117651, 2020 | 51 | 2020 |
Intramolecular general base catalysis in the hydrolysis of a phosphate diester. Calculational guidance to a choice of mechanism AJ Kirby, M Medeiros, JR Mora, PSM Oliveira, A Amer, NH Williams, ... The Journal of organic chemistry 78 (4), 1343-1353, 2013 | 46 | 2013 |
New light on phosphate transfer from triesters AJ Kirby, JR Mora, F Nome Biochimica et Biophysica Acta (BBA)-Proteins and Proteomics 1834 (1), 454-463, 2013 | 46 | 2013 |
Theoretical study of the importance of the spectator groups on the hydrolysis of phosphate triesters JR Mora, AJ Kirby, F Nome The Journal of Organic Chemistry 77 (16), 7061-7070, 2012 | 42 | 2012 |
Ensemble models based on QuBiLS-MAS features and shallow learning for the prediction of drug-induced liver toxicity: improving deep learning and traditional approaches JR Mora, Y Marrero-Ponce, CR García-Jacas, A Suarez Causado Chemical Research in Toxicology 33 (7), 1855-1873, 2020 | 41 | 2020 |
Differences in expression rather than methylation at placenta-specific imprinted loci is associated with intrauterine growth restriction A Monteagudo-Sánchez, M Sánchez-Delgado, JRH Mora, NT Santamaría, ... Clinical Epigenetics 11, 1-15, 2019 | 39 | 2019 |
Degradation of Methyl Paraoxon in the Presence of Mg2+-Al3+ Mixed Oxides LM Zimmermann, GI Almerindo, JR Mora, IH Bechtold, HD Fiedler, ... The Journal of Physical Chemistry C 117 (49), 26097-26105, 2013 | 34 | 2013 |
On the activation of σ-bonds by electric fields: A Valence Bond perspective L Rincón, JR Mora, FJ Torres, R Almeida Chemical Physics 477, 1-7, 2016 | 33 | 2016 |
Transforming a stable amide into a highly reactive one: Capturing the essence of enzymatic catalysis BS Souza, JR Mora, EH Wanderlind, RM Clementin, JC Gesser, ... Angewandte Chemie 129 (19), 5429-5432, 2017 | 30 | 2017 |
Polymers containing imidazole groups as nanoreactors for hydrolysis of esters LA Giusti, M Medeiros, NL Ferreira, JR Mora, HD Fiedler Journal of Physical Organic Chemistry 27 (4), 297-302, 2014 | 29 | 2014 |
Modelling the Anti-Methicillin-Resistant Staphylococcus Aureus (MRSA) Activity of Cannabinoids: A QSAR and Docking Study E Cortes, J Mora, E Márquez Crystals 10 (8), 692, 2020 | 25 | 2020 |
Molecular modeling studies of bromopyrrole alkaloids as potential antimalarial compounds: A DFT approach MC Flores, EA Márquez, JR Mora Medicinal Chemistry Research 27, 844-856, 2018 | 25 | 2018 |
New insight into the chloroacetanilide herbicide degradation mechanism through a nucleophilic attack of hydrogen sulfide JR Mora, C Cervantes, E Marquez International Journal of Molecular Sciences 19 (10), 2864, 2018 | 24 | 2018 |
In silico screening of the DrugBank database to search for possible drugs against SARS-CoV-2 SA Cuesta, JR Mora, EA Márquez Molecules 26 (4), 1100, 2021 | 23 | 2021 |
Theoretical study of the adsorption process of antimalarial drugs into acrylamide-base hydrogel model using DFT methods: The first approach to the rational design of a … E Cortes, E Márquez, JR Mora, E Puello, N Rangel, A De Moya, J Trilleras Processes 7 (7), 396, 2019 | 22 | 2019 |
Major mechanistic differences between the reactions of hydroxylamine with phosphate di-and tri-esters M Medeiros, EH Wanderlind, JR Mora, R Moreira, AJ Kirby, F Nome Organic & Biomolecular Chemistry 11 (37), 6272-6284, 2013 | 21 | 2013 |
QSAR and molecular docking modelling of anti-leishmanial activities of organic selenium and tellurium compounds N Cabrera, JR Mora, E Márquez, V Flores-Morales, L Calle, E Cortés SAR and QSAR in Environmental Research, 1-22, 2020 | 20 | 2020 |
Theoretical study of methoxy group influence in the gas‐phase elimination kinetics of methoxyalkyl chlorides O Brea, M Lorono, E Marquez, JR Mora, T Cordova, G Chuchani International Journal of Quantum Chemistry 112 (12), 2504-2514, 2012 | 20 | 2012 |
Designing an efficient and recoverable magnetic nanocatalyst based on Ca, Fe and pectin for biodiesel production SA Carrera, JS Villarreal, PI Acosta, JF Noboa, A Gallo-Cordova, JR Mora Fuel 310, 122456, 2022 | 19 | 2022 |
Experimental and theoretical study of the thermal decomposition of ethyl acetate during fast pyrolysis DC Vargas, S Salazar, JR Mora, KM Van Geem, DA Streitwieser Chemical Engineering Research and Design 157, 153-161, 2020 | 19 | 2020 |