Search Results - "Pérez Sánchez, Horacio"

Characterization of Oxygenated Propenylbenzene Derivatives Binding to MAO-A Using Isothermal Titration Calorimetry and Molecular Modeling.

Authors: Grzelczyk, Joanna Pérez-Sánchez, Horacio Carmena-Bargueño, Miguel et al.

Source: Applied Sciences (2076-3417); Dec2024, Vol. 14 Issue 23, p10856, 12p

WISCA: A Consensus-Based Approach to Harmonizing Interpretability in Tabular Datasets.

Authors: Banegas-Luna, Antonio Jesús Pérez-Sánchez, Horacio Martínez-Cortés, Carlos

Source: Machine Learning & Knowledge Extraction; Apr2026, Vol. 8 Issue 4, p97, 22p

Interaction of an anticancer oxygenated propenylbenzene derivatives with human topoisomerase II α and actin: molecular modeling and isothermal titration calorimetry studies.

Authors: Grzelczyk, Joanna Pérez-Sánchez, Horacio Nelen, Jochem et al.

Source: Journal of Thermal Analysis & Calorimetry. Jan2025, Vol. 150 Issue 2, p1275-1288. 14p.

[Corrigendum] Hepatoprotective activity of chrysin is mediated through TNF-α in chemically-induced acute liver damage: An in vivo study and molecular modeling.

Authors: Hermenean, Anca Mariasiu, Teodora Navarro-González, Inmaculada et al.

Source: Experimental & Therapeutic Medicine. Mar2026, Vol. 31 Issue 3, pN.PAG-N.PAG. 1p.

OBE‐DB: A Computational Tool and Web Server for the Prediction of Obesity Drugs.

Authors: Murcia‐García, Elena Martínez‐Cortés, Carlos Banegas‐Luna, Antonio J. et al.

Source: Obesity (19307381). Mar2026, Vol. 34 Issue 3, p630-640.

Discovery of Novel Molecular Scaffolds to Overcome Pseudomonas aeruginosa Aminoglycoside Resistance: Insights for a Consensus Scoring Rational Design Approach.

Authors: Iesce, Francesco Nelen, Jochem Rodríguez-Martínez, Alejandro et al.

Source: International Journal of Molecular Sciences. Mar2026, Vol. 27 Issue 6, p2642. 28p.

SIBILA: Automated Machine-Learning-Based Development of Interpretable Machine-Learning Models on High-Performance Computing Platforms.

Authors: Banegas-Luna, Antonio Jesús Pérez-Sánchez, Horacio

Source: AI. Dec2024, Vol. 5 Issue 4, p2353-2374. 22p.

Efficient GPU-based parallelization of solvation calculation for the blind docking problem.

Authors: Saadi, Hocine Nouali Taboudjemat, Nadia Rahmoun, Abdellatif et al.

Source: Journal of Supercomputing; Mar2020, Vol. 76 Issue 3, p1980-1998, 19p

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Effect of Silibinin on Human Pancreatic Lipase Inhibition and Gut Microbiota in Healthy Volunteers: A Randomized Controlled Trial.

Authors: Ponce Martínez, Cristina Murcia García, Elena Pérez Sánchez, Horacio et al.

Source: International Journal of Molecular Sciences. Dec2024, Vol. 25 Issue 23, p12853. 15p.

Analysis of AlphaFold and molecular dynamics structure predictions of mutations in serpins.

Authors: Garrido-Rodríguez, Pedro Carmena-Bargueño, Miguel de la Morena-Barrio, María Eugenia et al.

Source: PLoS ONE. 7/5/2024, Vol. 19 Issue 7, p1-21. 21p.

Global and Local Interpretable Machine Learning Allow Early Prediction of Unscheduled Hospital Readmission.

Authors: Ruiz de San Martín, Rafael Morales-Hernández, Catalina Barberá, Carmen et al.

Source: Machine Learning & Knowledge Extraction; Sep2024, Vol. 6 Issue 3, p1653-1666, 14p

Effects of In Vitro Digestion of Polyphenols from Coffee on Binding Parameters to Human Topoisomerase II α.

Authors: Grzelczyk, Joanna Pérez-Sánchez, Horacio Carmena-Bargueño, Miguel et al.

Source: Molecules. Aug2023, Vol. 28 Issue 16, p5996. 18p.

Discovery of Z1362873773: a novel fascin inhibitor from a large chemical library for colorectal cancer.

Authors: Rodríguez-Martínez, Alejandro Giraldo-Ruiz, Lucía Ramos, María C. et al.

Source: Scientific Reports. 4/28/2025, Vol. 15 Issue 1, p1-15. 15p.

Enhancing drug repositioning: A multi-class ensemble model for drug-target interaction prediction with action type categorization.

Authors: Jafari Khouzani, Leila Sardari, Soroush Jafari Khouzani, Soheila et al.

Source: PLoS ONE. 12/15/2025, Vol. 20 Issue 12, p1-26. 26p.

Synergizing Virtual Screening and Zebrafish Models to Identify Resveratrol-Derived Antiaging Polyphenols.

Authors: Hernández-Silva, David Cabello, Cynthia Cayuela, María Luisa et al.

Source: Pharmaceuticals (14248247). Nov2025, Vol. 18 Issue 11, p1630. 18p.

Interpreting the Conformational Dynamics Over Interaction of FAM222A Protein with Amyloid-Beta Peptides.

Authors: Besli, Nail Ercin, Nilufer Carmena-Bargueño, Miguel et al.

Source: Acta Chimica Slovenica. 2025, Vol. 72 Issue 4, p831-845. 15p.

Intermolecular Carbonyl–olefin Metathesis with Vinyl Ethers Catalyzed by Homogeneous and Solid Acids in Flow.

Authors: Rivero‐Crespo, Miguel Ángel Tejeda‐Serrano, María Pérez‐Sánchez, Horacio et al.

Source: Angewandte Chemie International Edition. 3/2/2020, Vol. 59 Issue 10, p3846-3849. 4p.

ALMERIA: Boosting Pairwise Molecular Contrasts with Scalable Methods.

Authors: Mena-Yedra, Rafael López Redondo, Juana Pérez-Sánchez, Horacio et al.

Source: Informatica. 2024, Vol. 35 Issue 3, p617-648. 32p.

An Interpretable Machine Learning Approach to Predict Sensory Processing Sensitivity Trait in Nursing Students.

Authors: Ponce-Valencia, Alicia Jiménez-Rodríguez, Diana Hernández Morante, Juan José et al.

Source: European Journal of Investigation in Health, Psychology & Education (EJIHPE). Apr2024, Vol. 14 Issue 4, p913-928. 16p.