| ROBERT: bridging the gap between machine learning and chemistry D Dalmau, JV Alegre‐Requena Wiley Interdisciplinary Reviews: Computational Molecular Science 14 (5), e1733, 2024 | 20 | 2024 |
| Luminescence and palladium: The odd couple D Dalmau, EP Urriolabeitia Molecules 28 (6), 2663, 2023 | 19 | 2023 |
| Fluorescent Orthopalladated Complexes of 4-Aryliden-5(4H)-oxazolones from the Kaede Protein: Synthesis and Characterization E Laga, D Dalmau, S Arregui, O Crespo, AI Jimenez, A Pop, C Silvestru, ... Molecules 26 (5), 1238, 2021 | 10 | 2021 |
| Recent advances of machine learning applications in the development of experimental homogeneous catalysis N Sanosa, D Dalmau, D Sampedro, JV Alegre-Requena, I Funes-Ardoiz Artificial Intelligence Chemistry, 100068, 2024 | 7 | 2024 |
| Reactivity of (Z)-4-Aryliden-5(4H)-thiazolones: [2 + 2]-Photocycloaddition, Ring-Opening Reactions, and Influence of the Lewis Acid BF3 S Sierra, D Dalmau, S Higuera, D Cortés, O Crespo, AI Jimenez, A Pop, ... The Journal of Organic Chemistry 86 (17), 12119-12140, 2021 | 6 | 2021 |
| Integrating digital chemistry within the broader chemistry community D Dalmau, JV Alegre-Requena Trends in Chemistry, 2024 | 5 | 2024 |
| Fluorescence Amplification of Unsaturated Oxazolones Using Palladium: Photophysical and Computational Studies D Dalmau, O Crespo, JM Matxain, EP Urriolabeitia Inorganic Chemistry 62 (25), 9792-9806, 2023 | 5 | 2023 |
| Synthesis of Bis(amino acids) Containing the Styryl-cyclobutane Core by Photosensitized [2+2]-Cross-cycloaddition of Allylidene-5(4H)-oxazolones S Sierra, D Dalmau, JV Alegre-Requena, A Pop, C Silvestru, ML Marín, ... International Journal of Molecular Sciences 24 (8), 7583, 2023 | 2 | 2023 |
| Different Patterns of Pd-Promoted C-H Bond Activation in (Z)-4-Hetarylidene-5(4H)-oxazolones and Consequences in Photophysical Properties M Martínez, D Dalmau, O Crespo, P García-Orduña, F Lahoz, A Martín, ... Inorganics 12 (10), 271, 2024 | 1 | 2024 |
| Comparing Hyper-optimized Machine Learning Models for Predicting Efficiency Degradation in Organic Solar Cells D Valiente, F Rodríguez-Mas, JV Alegre-Requena, D Dalmau, M Flores, ... arXiv preprint arXiv:2404.00173, 2024 | 1 | 2024 |
| Orthopalladated imidazolones and thiazolones: synthesis, photophysical properties and photochemical reactivity D Dumitraş, D Dalmau, P García-Orduña, A Pop, A Silvestru, ... Dalton Transactions 53 (21), 8948-8957, 2024 | 1 | 2024 |
| Synthesis and characterization of orthopalladated complexes containing tridentate C, N, O-oxazolones D Dalmau, AI Jiménez, EP Urriolabeitia Polyhedron 222, 115904, 2022 | 1 | 2022 |
| Optimization of Catalysts using Computational Chemistry, Machine Learning, and Cheminformatics DDJV Alegre-Requena Artificial Intelligence in Catalysis: Experimental and Computational …, 2025 | | 2025 |
| Investigating Reactivity and Selectivity in a Palladium-Catalyzed Heteroleptic Ligand System for Electrophilic Arene Fluorination S Deolka, MH Samha, A Garcia Roca, GC Haug, JR Howard, D Dalmau, ... Journal of the American Chemical Society, 2025 | | 2025 |
| Data‐Driven Analysis of Ni‐Catalyzed Semihydrogenations of Alkynes M Martinez‐Fernandez, MB Yeamin, D Dalmau, JJ Carbó, A Poater, ... Advanced Synthesis & Catalysis, e202401444, 2025 | | 2025 |
| Systematic Investigation of the Role of the Epoxides as Substrates for CO2 Capture in the Cycloaddition Reaction Catalysed by Ascorbic Acid T Ortiz-García, S Posada-Pérez, L El-Khchin, D Dalmau, A Poater, M Solà, ... Industrial Chemistry & Materials, 2025 | | 2025 |
| Machine learning workflows beyond linear models in low-data regimes D Dalmau, MS Sigman, JV Alegre-Requena Chemical Science 16 (19), 8555-8560, 2025 | | 2025 |
| Synthesis of β‐Aryl‐α, β‐Dehydroaminophosphonates by Pd‐Catalyzed Fujiwara–Moritani C− C Coupling J Sáez, D Dalmau, FJ Sayago, EP Urriolabeitia European Journal of Organic Chemistry 27 (18), e202400146, 2024 | | 2024 |
Esteban P. UrriolabeitiaSenior researcher, ISQCH (CSIC-Universidad de Zaragoza)Verified email at unizar.es
