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Adsorption of Mercury on Oxidized Graphenes.
Tene T, Bellucci S, Guevara M, Arias Arias F, Sáez Paguay MÁ, Quispillo Moyota JM, Arias Polanco M, Scarcello A, Vacacela Gomez C, Straface S, Caputi LS, Torres FJ. Tene T, et al. Nanomaterials (Basel). 2022 Aug 31;12(17):3025. doi: 10.3390/nano12173025. Nanomaterials (Basel). 2022. PMID: 36080061 Free PMC article.
Generalized Molecular Descriptors Derived From Event-Based Discrete Derivative.
Martínez-Santiago O, Cabrera RM, Marrero-Ponce Y, Barigye SJ, Le-Thi-Thu H, Torres FJ, Zambrano CH, Yaber-Goenaga I, Cruz-Monteagudo M, López YM, Giménez FP, Torrens F. Martínez-Santiago O, et al. Curr Pharm Des. 2016;22(33):5095-5113. doi: 10.2174/1381612822666160610114148. Curr Pharm Des. 2016. PMID: 27852205 Review.
Exploring the Non-Covalent Bonding in Water Clusters.
Seijas LE, Zambrano CH, Almeida R, Alí-Torres J, Rincón L, Torres FJ. Seijas LE, et al. Int J Mol Sci. 2023 Mar 9;24(6):5271. doi: 10.3390/ijms24065271. Int J Mol Sci. 2023. PMID: 36982342 Free PMC article.
Interaction of the new inhibitor paxlovid (PF-07321332) and ivermectin with the monomer of the main protease SARS-CoV-2: A volumetric study based on molecular dynamics, elastic networks, classical thermodynamics and SPT.
Alvarado YJ, Olivarez Y, Lossada C, Vera-Villalobos J, Paz JL, Vera E, Loroño M, Vivas A, Torres FJ, Jeffreys LN, Hurtado-León ML, González-Paz L. Alvarado YJ, et al. Comput Biol Chem. 2022 Aug;99:107692. doi: 10.1016/j.compbiolchem.2022.107692. Epub 2022 May 14. Comput Biol Chem. 2022. PMID: 35640480 Free PMC article.
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