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Structure-Based Optimization of Carbendazim-Derived Tubulin Polymerization Inhibitors through Alchemical Free Energy Calculations.
Cano-González L, Espinosa-Mendoza JD, Matadamas-Martínez F, Romero-Velásquez A, Flores-Ramos M, Colorado-Pablo LF, Cerbón-Cervantes MA, Castillo R, González-Sánchez I, Yépez-Mulia L, Hernández-Campos A, Aguayo-Ortiz R. Cano-González L, et al. J Chem Inf Model. 2023 Nov 27;63(22):7228-7238. doi: 10.1021/acs.jcim.3c01379. Epub 2023 Nov 10. J Chem Inf Model. 2023. PMID: 37947759
Species-Specific Inactivation of Triosephosphate Isomerase from Trypanosoma brucei: Kinetic and Molecular Dynamics Studies.
Vázquez-Raygoza A, Cano-González L, Velázquez-Martínez I, Trejo-Soto PJ, Castillo R, Hernández-Campos A, Hernández-Luis F, Oria-Hernández J, Castillo-Villanueva A, Avitia-Domínguez C, Sierra-Campos E, Valdez-Solana M, Téllez-Valencia A. Vázquez-Raygoza A, et al. Among authors: cano gonzalez l. Molecules. 2017 Nov 24;22(12):2055. doi: 10.3390/molecules22122055. Molecules. 2017. PMID: 29186784 Free PMC article.