Diffusion Graph Neural Networks for Robustness in Olfaction Sensors and Datasets

Kordel K. France, Ovidiu Daescu

Published: 2025/5/31

Abstract

Robotic odour source localization (OSL) is a critical capability for autonomous systems operating in complex environments. However, current OSL methods often suffer from ambiguities, particularly when robots misattribute odours to incorrect objects due to limitations in olfactory datasets and sensor resolutions. To address this challenge, we introduce a novel machine learning method using diffusion-based molecular generation to enhance odour localization accuracy that can be used by itself or with automated olfactory dataset construction pipelines. This generative process of our diffusion model expands the chemical space beyond the limitations of both current olfactory datasets and training methods, enabling the identification of potential odourant molecules not previously documented. The generated molecules can then be more accurately validated using advanced olfactory sensors, enabling them to detect more compounds and inform better hardware design. By integrating visual analysis, language processing, and molecular generation, our framework enhances the ability of olfaction-vision models on robots to accurately associate odours with their correct sources, thereby improving navigation and decision-making through better sensor selection for a target compound in critical applications such as explosives detection, narcotics screening, and search and rescue. Our methodology represents a foundational advancement in the field of artificial olfaction, offering a scalable solution to challenges posed by limited olfactory data and sensor ambiguities. Code and data are made available to the community at the following URL: https://github.com/KordelFranceTech/OlfactionVisionLanguage-Dataset.