VALCARCEL, Camilo BLANCO, Linda Porque es importante clasificar y designar nuevos frmacos? farmacogenmica farmacogentica VIAS SUBLINGAL TOPICA ORAL PARENTERAL Caracterizacin molecular no numrica a base de grafos J. Med. Chem. 2010, Investigation of the Relationship between Topology and Selectivity for Druglike Molecules Estructura molecular Dipirona topologa molecular R. Oka et al. / Journal of Molecular Graphics and Modelling, Investigation of the influence of molecular topology on ligand binding Naproxeno: 2TR Estructura molecular Estructura molecular Acetaminofen: 1TR Fuente: chemicalize.org
eficiencia ligando (LE) eficiencia lipoflica (LLE) y ligando eficiencia lipofilia (LELP) Journal of Molecular Graphics and Modelling(2013)Investigation of the influence of molecular topology on ligand binding CONCLUCIONES GRACIAS