Computational strategies for the discovery of biological functions of health foods, nutraceuticals and cosmeceuticals: a review LE Carpio, Y Sanz, R Gozalbes, SJ Barigye Molecular diversity 25, 1425-1438, 2021 | 16 | 2021 |
Targeting the aryl hydrocarbon receptor with a novel set of triarylmethanes E Goya-Jorge, C Rampal, N Loones, SJ Barigye, LE Carpio, R Gozalbes, ... European Journal of Medicinal Chemistry 207, 112777, 2020 | 10 | 2020 |
Identification of the phospholipid binding regions of the envelope E protein of flaviviruses by molecular dynamics LE Carpio, J Villalaín Journal of Biomolecular Structure and Dynamics 38 (17), 5136-5147, 2020 | 9 | 2020 |
Discovery of 2-aryl and 2-pyridinylbenzothiazoles endowed with antimicrobial and aryl hydrocarbon receptor agonistic activities E Goya-Jorge, F Abdmouleh, LE Carpio, RM Giner, MSI Veitía European Journal of Pharmaceutical Sciences 151, 105386, 2020 | 8 | 2020 |
Structure-Based Design and Synthesis of Stapled 10Panx1 Analogues for Use in Cardiovascular Inflammatory Diseases A Lamouroux, M Tournier, D Iaculli, A Caufriez, OM Rusiecka, C Martin, ... Journal of medicinal chemistry 66 (18), 13086-13102, 2023 | 1 | 2023 |
ProtoPRED: An Innovative Platform for the Prediction of Toxicological Properties of Small Molecules and Nanomaterials M Palomino-Schätzlein, S Moncho, JL Vallés-Pardo, A Goya, L Carpio, ... MDPI, 2024 | | 2024 |
Computational Modeling of DYRK1A Inhibitors as Potential Anti-Alzheimer Agents E Serrano-Candelas, LE Carpio, R Gozalbes Computational Modeling of Drugs Against Alzheimer’s Disease, 295-324, 2023 | | 2023 |
Diseño e implementación de un software para el análisis de la dinámica molecular de macromoléculas simulada mediante técnicas de Monte Carlo LE CARPIO MULA Universitat Politècnica de València, 2018 | | 2018 |