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Key objectives in conditional molecular generation include ensuring chemical validity, aligning generated molecules with target properties, promoting structural diversity, and enabling efficient sampling for discovery. Recent advances in…

While diffusion models have achieved great success in generating continuous signals such as images and audio, it remains elusive for diffusion models in learning discrete sequence data like natural languages. Although recent advances…

Computation and Language · Computer Science 2024-05-02 Jiasheng Ye , Zaixiang Zheng , Yu Bao , Lihua Qian , Mingxuan Wang

In recent times, large datasets hinder efficient model training while also containing redundant concepts. Dataset distillation aims to synthesize compact datasets that preserve the knowledge of large-scale training sets while drastically…

Computer Vision and Pattern Recognition · Computer Science 2026-02-27 Ayush Roy , Wei-Yang Alex Lee , Rudrasis Chakraborty , Vishnu Suresh Lokhande

Guidance techniques are simple yet effective for improving conditional generation in diffusion models. Albeit their empirical success, the practical implementation of guidance diverges significantly from its theoretical motivation. In this…

Computer Vision and Pattern Recognition · Computer Science 2025-05-26 Zhengqi Gao , Kaiwen Zha , Tianyuan Zhang , Zihui Xue , Duane S. Boning

Diffusion models, and their generalization, flow matching, have had a remarkable impact on the field of media generation. Here, the conventional approach is to learn the complex mapping from a simple source distribution of Gaussian noise to…

Computer Vision and Pattern Recognition · Computer Science 2025-03-25 Qihao Liu , Xi Yin , Alan Yuille , Andrew Brown , Mannat Singh

Guidance provides a simple and effective framework for posterior sampling by steering the generation process towards the desired distribution. When modeling discrete data, existing approaches mostly focus on guidance with the first-order…

Machine Learning · Computer Science 2026-04-16 Zhengyan Wan , Yidong Ouyang , Liyan Xie , Fang Fang , Hongyuan Zha , Guang Cheng

Diffusion models, a powerful and universal generative AI technology, have achieved tremendous success in computer vision, audio, reinforcement learning, and computational biology. In these applications, diffusion models provide flexible…

Machine Learning · Computer Science 2024-04-12 Minshuo Chen , Song Mei , Jianqing Fan , Mengdi Wang

Is it possible to understand the intricacies of a dynamical system not solely from its input/output pattern, but also by observing the behavior of other systems within the same class? This central question drives the study presented in this…

Systems and Control · Electrical Eng. & Systems 2023-12-21 Marco Forgione , Filippo Pura , Dario Piga

We propose LOGDIFF (Logical Guidance for the Exact Composition of Diffusion Models), a guidance framework for diffusion models that enables principled constrained generation with complex logical expressions at inference time. We study when…

Machine Learning · Computer Science 2026-03-24 Francesco Alesiani , Jonathan Warrell , Tanja Bien , Henrik Christiansen , Matheus Ferraz , Mathias Niepert

Recent improvements in conditional generative modeling have made it possible to generate high-quality images from language descriptions alone. We investigate whether these methods can directly address the problem of sequential…

Machine Learning · Computer Science 2023-07-11 Anurag Ajay , Yilun Du , Abhi Gupta , Joshua Tenenbaum , Tommi Jaakkola , Pulkit Agrawal

This paper presents Diffusion Forcing, a new training paradigm where a diffusion model is trained to denoise a set of tokens with independent per-token noise levels. We apply Diffusion Forcing to sequence generative modeling by training a…

Machine Learning · Computer Science 2024-12-11 Boyuan Chen , Diego Marti Monso , Yilun Du , Max Simchowitz , Russ Tedrake , Vincent Sitzmann

Creating large-scale datasets for training high-performance generative models is often prohibitively expensive, especially when associated attributes or annotations must be provided. As a result, merging existing datasets has become a…

Machine Learning · Statistics 2026-03-31 Yanfeng Yang , Kenji Fukumizu

Diffusion models transform noise into data by injecting information that was captured in their neural network during the training phase. In this paper, we ask: \textit{what} is this information? We find that, in pixel-space diffusion…

Machine Learning · Computer Science 2026-02-02 Akhil Premkumar

We explore the methodology and theory of reward-directed generation via conditional diffusion models. Directed generation aims to generate samples with desired properties as measured by a reward function, which has broad applications in…

Machine Learning · Computer Science 2023-07-17 Hui Yuan , Kaixuan Huang , Chengzhuo Ni , Minshuo Chen , Mengdi Wang

Recent studies have demonstrated that diffusion models are capable of generating high-quality samples, but their quality heavily depends on sampling guidance techniques, such as classifier guidance (CG) and classifier-free guidance (CFG).…

Computer Vision and Pattern Recognition · Computer Science 2025-07-08 Donghoon Ahn , Hyoungwon Cho , Jaewon Min , Wooseok Jang , Jungwoo Kim , SeonHwa Kim , Hyun Hee Park , Kyong Hwan Jin , Seungryong Kim

Classifier-free guidance (CFG) has become an essential component of modern conditional diffusion models. Although highly effective in practice, the underlying mechanisms by which CFG enhances quality, detail, and prompt alignment are not…

Machine Learning · Computer Science 2025-06-25 Seyedmorteza Sadat , Tobias Vontobel , Farnood Salehi , Romann M. Weber

We present a supervised learning framework of training generative models for density estimation. Generative models, including generative adversarial networks, normalizing flows, variational auto-encoders, are usually considered as…

Machine Learning · Computer Science 2023-10-24 Yanfang Liu , Minglei Yang , Zezhong Zhang , Feng Bao , Yanzhao Cao , Guannan Zhang

We propose Context Diffusion, a diffusion-based framework that enables image generation models to learn from visual examples presented in context. Recent work tackles such in-context learning for image generation, where a query image is…

Computer Vision and Pattern Recognition · Computer Science 2025-07-24 Ivona Najdenkoska , Animesh Sinha , Abhimanyu Dubey , Dhruv Mahajan , Vignesh Ramanathan , Filip Radenovic

Classifier-Free Guidance (CFG) enhances the quality and condition adherence of text-to-image diffusion models. It operates by combining the conditional and unconditional predictions using a fixed weight. However, recent works vary the…

Computer Vision and Pattern Recognition · Computer Science 2025-01-23 Xi Wang , Nicolas Dufour , Nefeli Andreou , Marie-Paule Cani , Victoria Fernandez Abrevaya , David Picard , Vicky Kalogeiton

Deep generative models, such as generative adversarial networks and diffusion models, have recently emerged as powerful tools for planning tasks and behavior synthesis in autonomous systems. Various guidance strategies have been introduced…

Machine Learning · Computer Science 2025-01-23 Francesco Giacomarra , Mehran Hosseini , Nicola Paoletti , Francesca Cairoli
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