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Identification of Riluzole derivatives as novel calmodulin inhibitors with neuroprotective activity by a joint synthesis, biosensor, and computational guided strategy.
Baltasar-Marchueta M, Llona L, M-Alicante S, Barbolla I, Ibarluzea MG, Ramis R, Salomon AM, Fundora B, Araujo A, Muguruza-Montero A, Nuñez E, Pérez-Olea S, Villanueva C, Leonardo A, Arrasate S, Sotomayor N, Villarroel A, Bergara A, Lete E, González-Díaz H. Baltasar-Marchueta M, et al. Among authors: gonzalez diaz h. Biomed Pharmacother. 2024 May;174:116602. doi: 10.1016/j.biopha.2024.116602. Epub 2024 Apr 17. Biomed Pharmacother. 2024. PMID: 38636396 Free article.
MATEO: intermolecular α-amidoalkylation theoretical enantioselectivity optimization. Online tool for selection and design of chiral catalysts and products.
Carracedo-Reboredo P, Aranzamendi E, He S, Arrasate S, Munteanu CR, Fernandez-Lozano C, Sotomayor N, Lete E, González-Díaz H. Carracedo-Reboredo P, et al. Among authors: gonzalez diaz h. J Cheminform. 2024 Jan 23;16(1):9. doi: 10.1186/s13321-024-00802-7. J Cheminform. 2024. PMID: 38254200 Free PMC article.
OptiMo-LDLr: An Integrated In Silico Model with Enhanced Predictive Power for LDL Receptor Variants, Unraveling Hot Spot Pathogenic Residues.
Larrea-Sebal A, Sasiain I, Jebari-Benslaiman S, Galicia-Garcia U, Uribe KB, Benito-Vicente A, Gracia-Rubio I, Bediaga-Bañeres H, Arrasate S, Cenarro A, Civeira F, González-Díaz H, Martín C. Larrea-Sebal A, et al. Among authors: gonzalez diaz h. Adv Sci (Weinh). 2024 Apr;11(13):e2305177. doi: 10.1002/advs.202305177. Epub 2024 Jan 23. Adv Sci (Weinh). 2024. PMID: 38258479 Free PMC article.
210 results