Geometric diffusion model for molecular generation

• Main Author: Mou, Bingyan
• Other Authors: Xia Kelin
• Format: Final Year Project
• Language: English
• Published: Nanyang Technological University 2024
• Subjects: Mathematical Sciences; Graph neural networks; Diffusion models; Molecular generation; Drug discovery
• Online Access: https://hdl.handle.net/10356/175669
• Institution: Nanyang Technological University

Significant progress has been made in the field of deep generative models, with notable examples such as ChatGPT and image-generation tools like Midjourney, Stable Diffusion, and DALL·E showcasing remarkable performance. One of the key mathematical models behind these advancements is denoising diffu...