A computational protocol for the calculation of the standard reduction potential of iron complexes: application to Fe(2+/3+)-Aβ model systems relevant to Alzheimer's disease

por Orjuela, Adrián L., Núñez-Zarur, Francisco, Alí-Torres, Jorge
Publicado 2022

Capping Amyloid β-Sheets of the Tau-Amyloid Structure VQIVYK with Hexapeptides Designed To Arrest Growth. An ONIOM and Density Functional Theory Study

por Plumley, Joshua A., Ali-Torres, Jorge, Pohl, Gabor, Dannenberg, J. J.
Publicado 2014

Role of Metal Cations of Copper, Iron, and Aluminum and Multifunctional Ligands in Alzheimer’s Disease: Experimental and Computational Insights

por Puentes-Díaz, Nicolás, Chaparro, Diego, Morales-Morales, David, Flores-Gaspar, Areli, Alí-Torres, Jorge
Publicado 2023

Exploring the Non-Covalent Bonding in Water Clusters

por Seijas, Luis E., Zambrano, Cesar H., Almeida, Rafael, Alí-Torres, Jorge, Rincón, Luis, Torres, Fernando Javier
Publicado 2023

A Theoretical Study of the C–X Bond Cleavage Mediated by Cob(II)Aloxime

por Seijas, Luis E., Zambrano, Cesar H., Rodríguez, Vladimir, Alí-Torres, Jorge, Rincón, Luis, Torres, F. Javier
Publicado 2022

Synthesis, Characterization, and Preliminary In Vitro Cytotoxic Evaluation of a Series of 2-Substituted Benzo [d] [1,3] Azoles

por Linares-Anaya, Ozvaldo, Avila-Sorrosa, Alcives, Díaz-Cedillo, Francisco, Gil-Ruiz, Luis Ángel, Correa-Basurto, José, Salazar-Mendoza, Domingo, Orjuela, Adrian L., Alí-Torres, Jorge, Ramírez-Apan, María Teresa, Morales-Morales, David
Publicado 2021