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Feature Transformation (FT) crafts new features from original ones via mathematical operations to enhance dataset expressiveness for downstream models. However, existing FT methods exhibit critical limitations: discrete search struggles…

机器学习 · 计算机科学 2025-05-22 Nanxu Gong , Zijun Li , Sixun Dong , Haoyue Bai , Wangyang Ying , Xinyuan Wang , Yanjie Fu

Understanding causal dependencies in observational data is critical for informing decision-making. These relationships are often modeled as Bayesian Networks (BNs) and Directed Acyclic Graphs (DAGs). Existing methods, such as NOTEARS and…

机器学习 · 计算机科学 2026-04-03 Hao Zhu , Di Zhou , Donna Slonim

Conditional diffusion models serve as the foundation of modern image synthesis and find extensive application in fields like computational biology and reinforcement learning. In these applications, conditional diffusion models incorporate…

机器学习 · 计算机科学 2024-03-19 Hengyu Fu , Zhuoran Yang , Mengdi Wang , Minshuo Chen

Geophysical inverse problems are often ill-posed and admit multiple solutions. Conventional discriminative methods typically yield a single deterministic solution, which fails to model the posterior distribution, cannot generate diverse…

地球物理 · 物理学 2025-06-17 Chuangji Meng , Jinghuai Gao , Wenting Shang , Yajun Tian , Hongling Chen , Tieqiang Zhang , Zongben Xu

Diffusion-based generative models (DBGMs) perturb data to a target noise distribution and reverse this process to generate samples. The choice of noising process, or inference diffusion process, affects both likelihoods and sample quality.…

机器学习 · 计算机科学 2023-03-06 Raghav Singhal , Mark Goldstein , Rajesh Ranganath

Score-based generative models (SGMs) have recently emerged as a promising class of generative models. However, a fundamental limitation is that their inference is very slow due to a need for many (e.g., 2000) iterations of sequential…

计算机视觉与模式识别 · 计算机科学 2022-12-06 Hengyuan Ma , Li Zhang , Xiatian Zhu , Jianfeng Feng

Post-hoc feature attribution methods are widely deployed in safety-critical vision systems, yet their stability under realistic input perturbations remains poorly characterized. Existing metrics evaluate explanations primarily under…

计算机视觉与模式识别 · 计算机科学 2026-04-06 Kamalasankari Subramaniakuppusamy , Jugal Gajjar

Forward regression is a crucial methodology for automatically identifying important predictors from a large pool of potential covariates. In contexts with moderate predictor correlation, forward selection techniques can achieve screening…

统计方法学 · 统计学 2024-08-23 Xuejun Jiang , Yue Ma , Haofeng Wang

Diffusion probabilistic models (DPMs) have become the state-of-the-art in high-quality image generation. However, DPMs have an arbitrary noisy latent space with no interpretable or controllable semantics. Although there has been significant…

机器学习 · 计算机科学 2024-08-27 Aneesh Komanduri , Chen Zhao , Feng Chen , Xintao Wu

Adapting to latent confounded shift remains a core challenge in modern AI. This setting is driven by hidden variables that induce spurious correlations between inputs and outputs during training, leading models to rely on non-causal…

机器学习 · 计算机科学 2026-05-14 Jialin Yu , Yuxiang Zhou , Haoxuan Li , Junchi Yu , Mengyue Yang , Yulan He , Nevin L. Zhang , Philip Torr , Ricardo Silva

Fairness in machine learning is increasingly critical, yet standard approaches often treat data as static points in a high-dimensional space, ignoring the underlying generative structure. We posit that sensitive attributes (e.g., race,…

机器学习 · 计算机科学 2026-01-07 Vidhi Rathore

The task of deducing three-dimensional molecular configurations from their two-dimensional graph representations holds paramount importance in the fields of computational chemistry and pharmaceutical development. The rapid advancement of…

生物大分子 · 定量生物学 2025-01-09 Bobin Yang , Jie Deng , Zhenghan Chen , Ruoxue Wu

Diffusion Probabilistic Models (DPMs) are powerful generative models that have achieved unparalleled success in a number of generative tasks. In this work, we aim to build inductive biases into the training and sampling of diffusion models…

机器学习 · 计算机科学 2025-03-14 Thomas Jiralerspong , Berton Earnshaw , Jason Hartford , Yoshua Bengio , Luca Scimeca

Diffusion model deployment has been suffering from high energy consumption and inference latency despite its superior performance in visual generation tasks. Dynamic voltage and frequency scaling (DVFS) offers a promising solution to…

硬件体系结构 · 计算机科学 2026-04-13 Jinqi Wen , Tong Xie , Runsheng Wang , Meng Li

While diffusion models can successfully generate data and make predictions, they are predominantly designed for static images. We propose an approach for efficiently training diffusion models for probabilistic spatiotemporal forecasting,…

机器学习 · 计算机科学 2023-10-12 Salva Rühling Cachay , Bo Zhao , Hailey Joren , Rose Yu

We propose a novel conditional diffusion model for contextual portfolio optimization that learns the cross-sectional distribution of next-day stock returns conditioned on high-dimensional asset-specific factors. Our model leverages a…

投资组合管理 · 定量金融 2026-04-17 Xuefeng Gao , Mengying He , Xuedong He

Classifier-Free Guidance (CFG) is a widely adopted technique in diffusion and flow-based generative models, enabling high-quality conditional generation. A key theoretical challenge is characterizing the distribution induced by CFG,…

机器学习 · 计算机科学 2025-05-23 Krunoslav Lehman Pavasovic , Jakob Verbeek , Giulio Biroli , Marc Mezard

Diffusion models offer stable training and state-of-the-art performance for deep generative modeling tasks. Here, we consider their use in the context of multivariate subsurface modeling and probabilistic inversion. We first demonstrate…

计算机视觉与模式识别 · 计算机科学 2026-01-28 Roberto Miele , Niklas Linde

Weighting methods are essential tools for estimating causal effects in observational studies, with the goal of balancing pre-treatment covariates across treatment groups. Traditional approaches pursue this objective indirectly, for example,…

统计方法学 · 统计学 2026-02-09 Diptanil Santra , Guanhua Chen , Chan Park

Diffusion models are known for generating high-quality images, causing serious security concerns. To combat this, most efforts rely on deep neural networks (e.g., CNNs and Transformers), while largely overlooking the potential of…

计算机视觉与模式识别 · 计算机科学 2026-04-16 Mengxin Fu , Yuezun Li