Consideration on points to keep in mind when using data science and artificial intelligence in toxicity evaluation research dealing with compounds (1)

Abstract

Various research methods and concepts (QSAR, AOP, WoE, MoA, IATA, etc.) have been proposed and developed to evaluate the toxicity of compounds and elucidate the mechanism. Rapidly evolving data science and artificial intelligence are becoming increasingly important on applying these diverse and complex studies. However, when applying data science or artificial intelligence in the field of handling chemical compounds, it is important to apply it correctly according to the purpose of analysis. In this presentation, we will discuss on these issues.