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Diffusion models have achieved remarkable progress in image and audio generation, largely due to Classifier-Free Guidance. However, the choice of guidance scale remains underexplored: a fixed scale often fails to generalize across prompts…

Sound · Computer Science 2025-10-07 Xuanhao Zhang , Chang Li

Gradient-based approximate inference methods, such as Stein variational gradient descent (SVGD), provide simple and general-purpose inference engines for differentiable continuous distributions. However, existing forms of SVGD cannot be…

Machine Learning · Computer Science 2020-03-03 Jun Han , Fan Ding , Xianglong Liu , Lorenzo Torresani , Jian Peng , Qiang Liu

In latent diffusion models (LDMs), denoising diffusion process efficiently takes place on latent space whose dimension is lower than that of pixel space. Decoder is typically used to transform the representation in latent space to that in…

Machine Learning · Computer Science 2024-09-30 Seongmin Hong , Suh Yoon Jeon , Kyeonghyun Lee , Ernest K. Ryu , Se Young Chun

Gradient Descent (GD) is a ubiquitous algorithm for finding the optimal solution to an optimization problem. For reduced computational complexity, the optimal solution $\mathrm{x^*}$ of the optimization problem must be attained in a minimum…

Optimization and Control · Mathematics 2023-06-01 Revati Gunjal , Sushama Wagh , Syed Shadab Nayyer , Alex Stankovic , Navdeep M. Singh

We consider Bayesian inference for large scale inverse problems, where computational challenges arise from the need for repeated evaluations of an expensive forward model. This renders most Markov chain Monte Carlo approaches infeasible,…

Numerical Analysis · Mathematics 2022-08-12 Daniel Zhengyu Huang , Jiaoyang Huang , Sebastian Reich , Andrew M. Stuart

Adding additional control to pretrained diffusion models has become an increasingly popular research area, with extensive applications in computer vision, reinforcement learning, and AI for science. Recently, several studies have proposed…

Machine Learning · Computer Science 2024-05-30 Yifei Shen , Xinyang Jiang , Yezhen Wang , Yifan Yang , Dongqi Han , Dongsheng Li

This work provides a computable, direct, and mathematically rigorous approximation to the differential geometry of class manifolds for high-dimensional data, along with nonlinear projections from input space onto these class manifolds. The…

Machine Learning · Computer Science 2023-08-24 Aaron Mahler , Tyrus Berry , Tom Stephens , Harbir Antil , Michael Merritt , Jeanie Schreiber , Ioannis Kevrekidis

In recent years, Explainable AI (XAI) methods have facilitated profound validation and knowledge extraction from ML models. While extensively studied for classification, few XAI solutions have addressed the challenges specific to regression…

Machine Learning · Computer Science 2025-07-21 Simon Letzgus , Klaus-Robert Müller , Grégoire Montavon

We study gradient inversion in the challenging single round averaged gradient SAG regime where per sample cues are entangled within a single batch mean gradient. We introduce MAGIA a momentum based adaptive correction on gradient inversion…

Computer Vision and Pattern Recognition · Computer Science 2025-09-24 Zhanting Zhou , Jinbo Wang , Zeqin Wu , Fengli Zhang

Diffusion models have achieved remarkable success in text-to-image synthesis, largely attributed to the use of classifier-free guidance (CFG), which enables high-quality, condition-aligned image generation. CFG combines the conditional…

Computer Vision and Pattern Recognition · Computer Science 2025-03-25 Mingi Kwon , Shin seong Kim , Jaeseok Jeong. Yi Ting Hsiao , Youngjung Uh

The standard probabilistic perspective on machine learning gives rise to empirical risk-minimization tasks that are frequently solved by stochastic gradient descent (SGD) and variants thereof. We present a formulation of these tasks as…

Machine Learning · Computer Science 2019-09-04 Nikola B. Kovachki , Andrew M. Stuart

Diffusion models have achieved remarkable success in synthesizing complex static and temporal visuals, a breakthrough largely driven by Classifier-Free Guidance (CFG). However, despite its pivotal role in aligning generated content with…

Computer Vision and Pattern Recognition · Computer Science 2026-04-30 Haosen Li , Wenshuo Chen , Lei Wang , Shaofeng Liang , Bowen Tian , Soning Lai , Yutao Yue

Explainable AI (XAI) methods are frequently applied to obtain qualitative insights about deep models' predictions. However, such insights need to be interpreted by a human observer to be useful. In this paper, we aim to use explanations…

Computer Vision and Pattern Recognition · Computer Science 2022-10-24 Sunsheng Gu , Vahdat Abdelzad , Krzysztof Czarnecki

Diffusion and flow-based generative models dominate visual synthesis, with guidance aligning samples to user input and improving perceptual quality. However, Classifier-Free Guidance (CFG) and extrapolation-based methods are heuristic…

Computer Vision and Pattern Recognition · Computer Science 2026-05-20 Parsa Esmati , Junha Hyung , Amirhossein Dadashzadeh , Jaegul Choo , Majid Mirmehdi

Advances in machine learning have led to graph neural network-based methods for drug discovery, yielding promising results in molecular design, chemical synthesis planning, and molecular property prediction. However, current graph neural…

Quantitative Methods · Quantitative Biology 2021-07-13 Jiahua Rao , Shuangjia Zheng , Yuedong Yang

In the domain of unsupervised image-to-image transformation using generative transformative models, CycleGAN has become the architecture of choice. One of the primary downsides of this architecture is its relatively slow rate of…

Computer Vision and Pattern Recognition · Computer Science 2023-12-07 Tibor Sloboda , Lukáš Hudec , Wanda Benešová

Machine Learning (ML)-based unfolding methods have enabled high-dimensional and unbinned differential cross section measurements. While a suite of such methods has been proposed, most focus exclusively on the challenge of statistically…

High Energy Physics - Phenomenology · Physics 2025-09-04 Anja Butter , Nathan Huetsch , Vinicius Mikuni , Benjamin Nachman , Sofia Palacios Schweitzer

In this paper, we present a novel derivative-free optimization framework for solving unconstrained stochastic optimization problems. Many problems in fields ranging from simulation optimization to reinforcement learning involve settings…

Optimization and Control · Mathematics 2024-04-19 Raghu Bollapragada , Cem Karamanli , Stefan M. Wild

Regressing rotations on SO(3) manifold using deep neural networks is an important yet unsolved problem. The gap between the Euclidean network output space and the non-Euclidean SO(3) manifold imposes a severe challenge for neural network…

Computer Vision and Pattern Recognition · Computer Science 2022-03-31 Jiayi Chen , Yingda Yin , Tolga Birdal , Baoquan Chen , Leonidas Guibas , He Wang

Trustworthy interpretation of deep learning models is critical for neuroimaging applications, yet commonly used Explainable AI (XAI) methods lack rigorous validation, risking misinterpretation. We performed the first large-scale, systematic…

Machine Learning · Computer Science 2025-08-07 Nys Tjade Siegel , James H. Cole , Mohamad Habes , Stefan Haufe , Kerstin Ritter , Marc-André Schulz