Numerical Investigation of Nucleotides’ Interaction Considering Changes Caused by Liquid Influences

Author:

Jasevičius Raimondas1ORCID

Affiliation:

1. Institute of Mechanical Science, Faculty of Mechanics, Vilnius Gediminas Technical University, Plytinės Str. 25, 10105 Vilnius, Lithuania

Abstract

This work is devoted to the interaction of nucleotides. The goal of this study is to learn or try to learn how the interaction between nucleotides with exposure to a liquid takes place. Will the interacting forces of the nucleotides be sufficient to approach the incision? A numerical imitation of the interaction is conducted using the discrete element method and a Gears predictor–corrector as part of the integrated scheme. In this work, the results reflect the dynamics of nucleotides: velocity, displacement, and force graphs are presented with and without the effect of the liquid. During changes caused by the influence of a liquid, the nucleotide interaction transforms and passes three stages: a full stop, one similar to viscous damping, and one similar to non-dissipative behaviors. The main contribution of this work is a better understanding of the behavior of infinitely small objects that would be difficult to observe in vivo. The changing influence of a liquid can transform into certain effects. As a result, a model is provided, which can be based on the results of well-known physical experiments (DNA unzipping) for modeling nucleotide interactions.

Publisher

MDPI AG

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