Category Archives: Publications

Transport properties of the square-well fluid from molecular dynamics simulation

M. Zerón,M. Cueto-Mora, F. J. BlasMol. Phys. 2024,DOI: 10.1080/00268976.2024.2302385  In this work, we have calculated [...]

Introducing 1,3-enyne functionalization by nitrene transfer reaction

M. Rodríguez, G. Sciortino, L. Muñoz-Gutiérrez, F. Molina, F. Maseras, M. Mar Díaz-Requejo, Pedro J. Pérez https://doi.org/10.1016/j.checat.2023.100865 In the context of carbon–nitrogen bond formation, metal-catalyzed nitrene transfer [...]

Azaborahelicene fluorophores derived from four-coordinate N,C-boron chelates: synthesis, photophysical and chiroptical properties

Vázquez-Domínguez, J. F. Rizo, J. F. Arteaga, D. Jacquemin, L. Favereau, A. Ros, U. Pischel. [...]

Molecular Dynamic Simulations of Aqueous Micellar Organometallic Catalysis: Methane Functionalization as a Case Study

Matamoros-Recio, E. Alonso-Rueda, E. Borrego, A. Caballero, S. Martín-Santamaría, P. J. PérezAngew. Chem. Int. Ed.2023, [...]

BASHY Dyes Are Highly Efficient Lipid Droplet-Targeting Photosensitizers that Induce Ferroptosis through Lipid Peroxidation

J. S. A. Silva, Y. Zhang, R. Vinck, F. M. F. Santos, J. P. M. [...]

Aerial monitoring of atmospheric particulate matter produced by open-pit mining using low-cost airborne sensors

Zafra-Pérez, C. Boente, M. García-Díaz, J. A. Gómez-Galán, A. Sánchez de la Campa, J. D. de la Rosa https://doi.org/10.1016/j.scitotenv.2023.166743 Mining is an economic activity [...]

Unpacking Occupational Health Data in the Service Sector: From Bayesian Networking and Spatial Clustering to Policy-Making

Pazo, C. Boente, T. Albuquerque, S. Gerassis, N. Roque, J. Taboada, Mathematical Geosciences 2023 https://doi.org/10.1007/s11004-023-10087-5 [...]

Dehydropolymerizationof Amine-Boranes using Bis(imino)pyridine Rhodium Pre-Catalysis: s-Amine-Borane Complexes, Nanoparticles, and Low Residual-Metal BN-Polymers that can be Chemically Repurposed

J. Cross, C. N. Brodie, D. G. Crivoi, J. C. Goodall, D. E. Ryan, A. [...]

Broad-Scope Amination of Aryl Sulfamates Catalyzed by a Palladium Phosphine Complex

Monti, J. López-Serrano, A. Prieto, M. C. Nicasio, ACS Catal. 2023 https://doi.org/10.1021/acscatal.3c03166 Among phenol-derived electrophiles, aryl sulfamates are [...]

Selective C-H bond functionalization of unprotected indoles bydonor-acceptor carbene insertion

D. Pizarro, L. Moran-Gonzalez, I. Gonzalez-Fernandez, F. Maseras, M. R. Fructos, P. J. Perez Adv. [...]