A Prospect of Glycine Atomic Topology in the Formation of Magnesium Nanocluster

Navnit Kumar Mishra and Anil Kumar Sharma

Abstract


Molecular dynamics simulations have shown a fair correlation between biological activity and the structure of biomolecule [1]. Moreover, the technique enables the science to interpret the consequences of any deviation in the molecule. In this study we have applied the MD simulations to understand the topological distribution of atoms in glycine amino acids and the effects of changing the atom type have been inferred. The study paves the way about the presence of peripheral atoms in the octahedron box which disintegrate relatively faster than the atoms in the centre of the box.

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