To improve selectivity and Sal003 reduce toxicity, delivery vehicle implementation inhuman subjects will require great care. Itis, therefore, imperative that we emphasize the Norethindrone fundamental chemical strategy and rationally approach the design of the vehicle suited for translational use. A better understanding of the interaction of venom toxins at the nanoscale is critical, which may dictate its overall stability, systemic integrity and cellular noxiousness. A carefully structured study to comprehend the interactions of melittin with the functional components at the shell and shell-surface will drive the design of next-generation delivery vehicles. Towards this end, we have adopted approach and developed a well-defined nanoparticulate system for controlled delivery of melittin. The goal of this work was to provide a rational nanoparticle-based design for venom delivery through computational studies and support our theoretical findings with physicochemical and biological studies. Thus, following the syntheses and physico-chemical characterization, a series of sequential experiments were carried out to study how nanoscale chemistry influences the delivery of venom toxins for cancer regression and help evade systemic disintegrity and cellular noxiousness. In silico studies revealed the higher stability response of melittin towards amphiphilic block polymers compared to lipid molecules. Experimental study confirmed the better stability of polymeric system over lipidic assembly. To introduce micellar stability, a concept of rigid core was introduced. Studies exploring change in hydrated size and inertness against serum proteins revealed the higher stability of rigid core particles. Experiments on melittin leaching in the presence of serum concentration revealed the higher stability of a melittin-polymer system compared to a melittin-lipid system. An in silico study on melittin-DNA interaction was performed and verified by experimental data. It was found that free melittin could bring significant change in inter-helix hydrogen bonding to potentially influence cell growth mechanisms. Melittin in its protected form as Polybee and Lipobee were inactive.