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Deep Metric Learning (DML) methods have been proven relevant for visual similarity learning. However, they sometimes lack generalization properties because they are trained often using an inappropriate sample selection strategy or due to…

Computer Vision and Pattern Recognition · Computer Science 2022-06-07 Jorge Gonzalez-Zapata , Ivan Reyes-Amezcua , Daniel Flores-Araiza , Mauricio Mendez-Ruiz , Gilberto Ochoa-Ruiz , Andres Mendez-Vazquez

Inverse design problems are common in engineering and materials science. The forward direction, i.e., computing output quantities from design parameters, typically requires running a numerical simulation, such as a FEM, as an intermediate…

Machine Learning · Computer Science 2026-02-18 Jens U. Kreber , Christian Weißenfels , Joerg Stueckler

Imperfect score-matching leads to a shift between the training and the sampling distribution of diffusion models. Due to the recursive nature of the generation process, errors in previous steps yield sampling iterates that drift away from…

Machine Learning · Computer Science 2023-02-20 Giannis Daras , Yuval Dagan , Alexandros G. Dimakis , Constantinos Daskalakis

Current language models demonstrate remarkable proficiency in text generation. However, for many applications it is desirable to control attributes, such as sentiment, or toxicity, of the generated language -- ideally tailored towards each…

Computation and Language · Computer Science 2024-08-09 Justin Lovelace , Varsha Kishore , Yiwei Chen , Kilian Q. Weinberger

Domain generalization aims to address the domain shift between training and testing data. To learn the domain invariant representations, the model is usually trained on multiple domains. It has been found that the gradients of network…

Computer Vision and Pattern Recognition · Computer Science 2023-06-21 Jiaqi Xu , Yuwang Wang , Xuejin Chen

Classifier-Free Guidance (CFG) has emerged as a central approach for enhancing semantic alignment in flow-based diffusion models. In this paper, we explore a unified framework called CFG-Ctrl, which reinterprets CFG as a control applied to…

Computer Vision and Pattern Recognition · Computer Science 2026-03-12 Hanyang Wang , Yiyang Liu , Jiawei Chi , Fangfu Liu , Ran Xue , Yueqi Duan

We study conditional generation in diffusion models under hard constraints, where generated samples must satisfy prescribed events with probability one. Such constraints arise naturally in safety-critical applications and in rare-event…

Artificial Intelligence · Computer Science 2026-03-10 Zhengyi Guo , Wenpin Tang , Renyuan Xu

Diffusion models can be improved with additional guidance towards more effective representations of input. Indeed, prior empirical work has already shown that aligning internal representations of the diffusion model with those of…

Machine Learning · Computer Science 2025-10-14 Chenyu Wang , Cai Zhou , Sharut Gupta , Zongyu Lin , Stefanie Jegelka , Stephen Bates , Tommi Jaakkola

In many real-world settings, agents must learn from an offline dataset gathered by some prior behavior policy. Such a setting naturally leads to distribution shift between the behavior policy and the target policy being trained - requiring…

Machine Learning · Computer Science 2024-04-10 Matthew Thomas Jackson , Michael Tryfan Matthews , Cong Lu , Benjamin Ellis , Shimon Whiteson , Jakob Foerster

Diffusion models have become emerging generative models. Their sampling process involves multiple steps, and in each step the models predict the noise from a noisy sample. When the models make prediction, the output deviates from the ground…

Machine Learning · Computer Science 2025-10-28 Shifeng Xu , Yanzhu Liu , Adams Wai-Kin Kong

Guided diffusion is a technique for conditioning the output of a diffusion model at sampling time without retraining the network for each specific task. One drawback of diffusion models, however, is their slow sampling process. Recent…

Computer Vision and Pattern Recognition · Computer Science 2023-01-30 Suttisak Wizadwongsa , Supasorn Suwajanakorn

Generative modeling is typically framed as learning mapping rules, but from an observer's perspective without access to these rules, the task becomes disentangling the geometric support from the probability distribution. We propose that…

Machine Learning · Statistics 2025-12-04 Rui Tong

We develop a general methodological framework for probabilistic inference in discrete- and continuous-time stochastic processes evolving on directed acyclic graphs (DAGs). The process is observed only at the leaf nodes, and the challenge is…

Methodology · Statistics 2025-05-27 Frank van der Meulen , Moritz Schauer , Stefan Sommer

Data scarcity drives the need for more sample-efficient large language models. In this work, we use the double descent phenomenon to holistically compare the sample efficiency of discrete diffusion and autoregressive models. We show that…

Machine Learning · Computer Science 2025-09-30 Ahmad Fraij , Sam Dauncey

Diffusion models achieve strong performance in generative modeling, but their success often relies heavily on classifier-free guidance (CFG), an inference-time heuristic that modifies the sampling trajectory. In theory, diffusion models…

Machine Learning · Computer Science 2026-05-14 Xiang Li , Yixuan Jia , Xiao Li , Jeffrey A. Fessler , Rongrong Wang , Qing Qu

Fast Adversarial Training (FAT) has proven effective in enhancing model robustness by encouraging networks to learn perturbation-invariant representations. However, FAT often suffers from catastrophic overfitting (CO), where the model…

Machine Learning · Computer Science 2026-04-28 Mengnan Zhao , Lihe Zhang , Bo Wang , Tianhang Zheng , Hong Zhong , Geyong Min

Diffusion models are powerful generative models that produce high-quality samples from complex data. While their infinite-data behavior is well understood, their generalization with finite data remains less clear. Classical learning theory…

Machine Learning · Statistics 2026-02-02 Claudia Merger , Sebastian Goldt

Classifier-free guidance (CFG) succeeds in condition diffusion models that use a guidance scale to balance the influence of conditional and unconditional terms. A high guidance scale is used to enhance the performance of the conditional…

Computer Vision and Pattern Recognition · Computer Science 2025-06-27 Kaiyu Song , Hanjiang Lai

Generative models have the potential to accelerate key steps in the discovery of novel molecular therapeutics and materials. Diffusion models have recently emerged as a powerful approach, excelling at unconditional sample generation and,…

Biomolecules · Quantitative Biology 2024-07-17 Leo Klarner , Tim G. J. Rudner , Garrett M. Morris , Charlotte M. Deane , Yee Whye Teh

Diffusion and flow-based models have enabled significant progress in generation tasks across various modalities and have recently found applications in predictive learning. However, unlike typical generation tasks that encourage sample…

Computer Vision and Pattern Recognition · Computer Science 2026-03-24 Yu Zhang , Xingzhuo Guo , Haoran Xu , Jialong Wu , Mingsheng Long