Design, synthesis and biological evaluation of novel thiosemicarbazones as cruzipain inhibitors
Gabriel Jasinski, Emir Salas‐Sarduy, Daniel Vega, Lucas Fabián, M. Florencia Martini, Albertina G. Moglioni
Topics & Concepts
ChemistryONIOMStereochemistryDocking (animal)Quantitative structure–activity relationshipKineticsMolecular modelAdductCombinatorial chemistryComputational chemistryMoleculeOrganic chemistryNursingMedicinePhysicsQuantum mechanicsBioactive Compounds and Antitumor AgentsComputational Drug Discovery MethodsPlant biochemistry and biosynthesis