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Automated docking for novel drug discovery.
Bello M, Martínez-Archundia M, Correa-Basurto J. Bello M, et al. Expert Opin Drug Discov. 2013 Jul;8(7):821-34. doi: 10.1517/17460441.2013.794780. Epub 2013 May 6. Expert Opin Drug Discov. 2013. PMID: 23642085 Review.
QSAR, docking, dynamic simulation and quantum mechanics studies to explore the recognition properties of cholinesterase binding sites.
Correa-Basurto J, Bello M, Rosales-Hernández MC, Hernández-Rodríguez M, Nicolás-Vázquez I, Rojo-Domínguez A, Trujillo-Ferrara JG, Miranda R, Flores-Sandoval CA. Correa-Basurto J, et al. Among authors: bello m. Chem Biol Interact. 2014 Feb 25;209:1-13. doi: 10.1016/j.cbi.2013.12.001. Epub 2013 Dec 7. Chem Biol Interact. 2014. PMID: 24321698
Seeking potential anticonvulsant agents that target GABAA receptors using experimental and theoretical procedures.
Saavedra-Vélez MV, Correa-Basurto J, Matus MH, Gasca-Pérez E, Bello M, Cuevas-Hernández R, García-Rodríguez RV, Trujillo-Ferrara J, Ramos-Morales FR. Saavedra-Vélez MV, et al. Among authors: bello m. J Comput Aided Mol Des. 2014 Dec;28(12):1217-32. doi: 10.1007/s10822-014-9798-z. Epub 2014 Oct 9. J Comput Aided Mol Des. 2014. PMID: 25298123
Targeting quorum sensing by designing azoline derivatives to inhibit the N-hexanoyl homoserine lactone-receptor CviR: Synthesis as well as biological and theoretical evaluations.
Bucio-Cano A, Reyes-Arellano A, Correa-Basurto J, Bello M, Torres-Jaramillo J, Salgado-Zamora H, Curiel-Quesada E, Peralta-Cruz J, Avila-Sorrosa A. Bucio-Cano A, et al. Among authors: bello m. Bioorg Med Chem. 2015 Dec 15;23(24):7565-77. doi: 10.1016/j.bmc.2015.10.046. Epub 2015 Nov 2. Bioorg Med Chem. 2015. PMID: 26654469 Free article.
840 results