Generative AI for 3D Molecular Structure Prediction Using Diffusion Models

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Authors: Raghab Singh
Cited by: 1

Abstract

It is essential to be able to create unbiased biological sub-comparative routes to study, to gain an empirical understanding of them. This study explains the exploration of a framework that uses generative artificial intelligence and diffusion-based learning. When drawing graph-based representations having geometric limitations the structures and atom to atom interactions must be valid. Enhancement in molecular stability accuracy achieved on the experimental assessment relative to customary generative approaches. These discoveries work against drugs design and discoveries using AI-driven methods are advantageous.

Fields of Study & Subjects

Machine Learning in Bioinformatics Computational Drug Discovery Methods Bioinformatics and Genomic Networks

Publication details

Publisher
Institute of Electrical and Electronics Engineers (IEEE)
Publication date
27 February 2026
Document type
Preprint