Evaluación computacional de la dinámica estructural de una biomolécula, luego de su interacción con partículas cargadas.

Abstract

In the field of research on the interaction of radiation and matter, a space has been opened for computational simulations, Which has turned into an important tool in the development of an investigation and in the approximation to the possible results that can be obtained when experimenting. This work presents the results of the effects of charged particles in the three dimensional structure of a biomolecule based on an simulation (pdb4dna) of the geant4 toolset, modified for the purpose of evaluating some parameters after the interaction of a biomolecule (1bb3.pdb) with radiation,These results were obtained during the internship development. On the other hand, the data was obtained by throught a new simulation, which was detached from the base code, where it obtains from deposited energy values. The analysis shown was done through ROOT software in order to compare the partial similarities among the two codes.