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Generative models are powerful tools for sampling from a learned distribution $\mathcal{P}(Y \mid X)$, and inverse-design methods invert this map to find an input $x$ that produces a desired point output $y^*$. However, many design goals…

Machine Learning · Computer Science 2026-05-12 Ori Meidler , Shaul Tolkovsky , Or Zuk

Restricted Boltzmann Machines (RBMs) are general unsupervised learning devices to ascertain generative models of data distributions. RBMs are often trained using the Contrastive Divergence learning algorithm (CD), an approximation to the…

Machine Learning · Computer Science 2014-04-10 David Buchaca , Enrique Romero , Ferran Mazzanti , Jordi Delgado

Machine learning approaches now achieve impressive generation capabilities in numerous domains such as image, audio or video. However, most training \& evaluation frameworks revolve around the idea of strictly modelling the original data…

Machine Learning · Computer Science 2022-11-17 Axel Chemla--Romeu-Santos , Philippe Esling

In this paper, we attack the anomaly detection problem by directly modeling the data distribution with deep architectures. We propose deep structured energy based models (DSEBMs), where the energy function is the output of a deterministic…

Machine Learning · Computer Science 2016-06-17 Shuangfei Zhai , Yu Cheng , Weining Lu , Zhongfei Zhang

By formulating data samples' formation as a Markov denoising process, diffusion models achieve state-of-the-art performances in a collection of tasks. Recently, many variants of diffusion models have been proposed to enable controlled…

Machine Learning · Computer Science 2023-04-17 Hengtong Zhang , Tingyang Xu

Deep neural networks (DNNs), despite their impressive ability to generalize over-capacity networks, often rely heavily on malignant bias as shortcuts instead of task-related information for discriminative tasks. To address this problem,…

Machine Learning · Computer Science 2023-07-06 Yeonsung Jung , Hajin Shim , June Yong Yang , Eunho Yang

We introduce a multi-modal diffusion model tailored for the bi-directional conditional generation of video and audio. We propose a joint contrastive training loss to improve the synchronization between visual and auditory occurrences. We…

Machine Learning · Computer Science 2024-10-10 Ruihan Yang , Hannes Gamper , Sebastian Braun

Sparse-view Computed Tomography (CT) image reconstruction is a promising approach to reduce radiation exposure, but it inevitably leads to image degradation. Although diffusion model-based approaches are computationally expensive and suffer…

Image and Video Processing · Electrical Eng. & Systems 2024-03-15 Hanyu Chen , Zhixiu Hao , Lin Guo , Liying Xiao

To sample from a general target distribution $p_*\propto e^{-f_*}$ beyond the isoperimetric condition, Huang et al. (2023) proposed to perform sampling through reverse diffusion, giving rise to Diffusion-based Monte Carlo (DMC).…

Machine Learning · Statistics 2024-01-15 Xunpeng Huang , Difan Zou , Hanze Dong , Yian Ma , Tong Zhang

Cross-modality distillation arises as an important topic for data modalities containing limited knowledge such as depth maps and high-quality sketches. Such techniques are of great importance, especially for memory and privacy-restricted…

Machine Learning · Computer Science 2024-05-29 Hangyu Lin , Chen Liu , Chengming Xu , Zhengqi Gao , Yanwei Fu , Yuan Yao

Adversarial Training (AT) is known as an effective approach to enhance the robustness of deep neural networks. Recently researchers notice that robust models with AT have good generative ability and can synthesize realistic images, while…

Machine Learning · Computer Science 2022-03-28 Yifei Wang , Yisen Wang , Jiansheng Yang , Zhouchen Lin

The ensemble average of physical properties of molecules is closely related to the distribution of molecular conformations, and sampling such distributions is a fundamental challenge in physics and chemistry. Traditional methods like…

Machine Learning · Computer Science 2025-08-06 Liya Guo , Zun Wang , Chang Liu , Junzhe Li , Pipi Hu , Yi Zhu

Distilling latent diffusion models (LDMs) into ones that are fast to sample from is attracting growing research interest. However, the majority of existing methods face two critical challenges: (1) They hinge on long training using a huge…

Computer Vision and Pattern Recognition · Computer Science 2024-11-08 Qingsong Xie , Zhenyi Liao , Zhijie Deng , Chen chen , Haonan Lu

Retrosynthesis -- the process of identifying a set of reactants to synthesize a target molecule -- is of vital importance to material design and drug discovery. Existing machine learning approaches based on language models and graph neural…

Chemical Physics · Physics 2021-12-10 Ruoxi Sun , Hanjun Dai , Li Li , Steven Kearnes , Bo Dai

This paper proposes the divergence triangle as a framework for joint training of generator model, energy-based model and inference model. The divergence triangle is a compact and symmetric (anti-symmetric) objective function that seamlessly…

Machine Learning · Statistics 2019-02-01 Tian Han , Erik Nijkamp , Xiaolin Fang , Mitch Hill , Song-Chun Zhu , Ying Nian Wu

Objective: Cone-beam computed tomography (CBCT) provides a low-dose imaging alternative to conventional CT, but suffers from noise, scatter, and artifacts that degrade image quality. Synthetic CT (sCT) aims to translate CBCT to high-quality…

Medical Physics · Physics 2025-09-23 Alzahra Altalib , Chunhui Li , Alessandro Perelli

Computational fluid dynamics (CFD) is a powerful tool for modeling turbulent flow and is commonly used for urban microclimate simulations. However, traditional CFD methods are computationally intensive, requiring substantial hardware…

We address the challenge of training diffusion models to sample from unnormalized energy distributions in the absence of data, the so-called diffusion samplers. Although these approaches have shown promise, they struggle to scale in more…

Machine Learning · Computer Science 2025-11-07 Minkyu Kim , Kiyoung Seong , Dongyeop Woo , Sungsoo Ahn , Minsu Kim

Discrete diffusion models (DDMs) are a powerful class of generative models for categorical data, but they typically require many function evaluations for a single sample, making inference expensive. Existing acceleration methods either rely…

Machine Learning · Computer Science 2025-12-16 Yansong Gao , Yu Sun

Class distribution mismatch (CDM) refers to the discrepancy between class distributions in training data and target tasks. Previous methods address this by designing classifiers to categorize classes known during training, while grouping…

Computer Vision and Pattern Recognition · Computer Science 2025-05-13 Pan Du , Wangbo Zhao , Xinai Lu , Nian Liu , Zhikai Li , Chaoyu Gong , Suyun Zhao , Hong Chen , Cuiping Li , Kai Wang , Yang You