Supramolecular control of reactivity toward hydrolysis of 7-diethylaminocoumarin Schiff bases by cucurbit [7] uril encapsulation JJ Alcázar, N Geue, V Valladares, A Canete, EG Pérez, L García-Río, ... ACS omega 6 (15), 10333-10342, 2021 | 20 | 2021 |
Classical QSAR and docking simulation of 4-pyridone derivatives for their antimalarial activity M Flores-Sumoza, JJ Alcázar, E Márquez, JR Mora, J Lezama, E Puello Molecules 23 (12), 3166, 2018 | 18 | 2018 |
Predicting the adsorption of amoxicillin and ibuprofen on chitosan and graphene oxide materials: a density functional theory study L Anchique, JJ Alcázar, A Ramos-Hernandez, M Méndez-López, JR Mora, ... polymers 13 (10), 1620, 2021 | 12 | 2021 |
Cucurbit [7] uril as a Supramolecular Catalyst in Base-Catalyzed Reactions. Experimental and Theoretical Studies on Carbonate and Thiocarbonate Hydrolysis Reactions A Fierro, L García-Río, S Arancibia-Opazo, JJ Alcázar, JG Santos, ... The Journal of Organic Chemistry 86 (2), 2023-2027, 2020 | 11 | 2020 |
Changes in Protonation Sites of 3-Styryl Derivatives of 7-(dialkylamino)-aza-coumarin Dyes Induced by Cucurbit[7]uril JJ Alcázar, E Márquez, L García-Río, A Robles-Muñoz, A Fierro, ... Frontiers in Chemistry 10, 2022 | 9 | 2022 |
Influence of β-Cyclodextrin Methylation on Host-Guest Complex Stability: A Theoretical Study of Intra-and Intermolecular Interactions as Well as Host Dimer Formation N Geue, JJ Alcázar, PR Campodónico Molecules 28 (6), 2625, 2023 | 6 | 2023 |
An efficient and eco-friendly method for the thiol-Michael addition in aqueous solutions using amino acid ionic liquids (AAILs) as organocatalysts R Figueroa Guíñez, JG Santos, RA Tapia, JJ Alcazar, ME Aliaga, P Pavez Pure and Applied Chemistry 92 (1), 97-106, 2020 | 3 | 2020 |
Theoretical calculations of the multistep reaction mechanism involved in asparagine pyrolysis supported by degree of rate control and thermodynamic control analyses C Cervantes, JR Mora, E Marquez, J Torres, L Rincón, MA Mendez, ... Applied Sciences 9 (22), 4847, 2019 | 3 | 2019 |
Linear relationship between emission quantum yield and Stokes shift in 3-styryl aza-coumarin based dyes in the presence of cyclodextrins JJ Alcázar, L García-Río, AI Robles, L Dinamarca-Villarroel, A Fierro, ... Journal of Molecular Liquids 381, 121790, 2023 | 2 | 2023 |
Theoretical study on the mechanism of the gas-phase elimination kinetics of alkyl chloroformates JJ Alcázar, E Marquez, JR Mora, T Cordova-Sintjago, G Chuchani Molecular Physics 114 (5), 719-729, 2016 | 2 | 2016 |
Exploring the Behavior of Candida antarctica lipase B in aqueous mixtures of an imidazolium ionic liquid and its surfactant analogue PR Campodónico, C Calderón, J Alcazar, B Olivares, L Jaldin, ... Frontiers in Chemistry 11, 1289398, 2024 | 1 | 2024 |
Reliable and accurate prediction of basic pK values in nitrogen compounds: the pK shift in supramolecular systems as a case study JJ Alcázar, AC Misad Saide, PR Campodónico Journal of Cheminformatics 15 (1), 90, 2023 | 1 | 2023 |
Thermal Decomposition Kinetics of Dicyclopentadiene‐1, 8‐dione: The Reaction Path through Quantum Chemical Calculation LV Amaiz, L Cartaya, E Marquez, JJ Alcázar, A Maldonado, JR Mora, ... International Journal of Chemical Kinetics 48 (12), 812-821, 2016 | 1 | 2016 |
Analysis of the Behavior of Deep Eutectic Solvents upon Addition of Water: Its Effects over a Catalytic Reaction PR Campodónico, J Alarcón-Espósito, JJ Alcázar, B Olivares, ... Molecules 29 (14), 3296, 2024 | | 2024 |
A Simple Machine Learning-Based Quantitative Structure-Activity Relationship Model for Predicting pIC50 Inhibition Values of FLT3 Tyrosine Kinase JJ Alcázar, I Sánchez, C Merino, B Monasterio, G Sajuria, D Miranda, ... Preprints, 2024 | | 2024 |
Thiophene Stability in Photodynamic Therapy: A Mathematical Model Approach JJ Alcázar International Journal of Molecular Sciences 25 (5), 2528, 2024 | | 2024 |