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Coarse-grained (CG) molecular simulations have become a standard tool to study molecular processes on time- and length-scales inaccessible to all-atom simulations. Parameterizing CG force fields to match all-atom simulations has mainly…

Computational Physics · Physics 2023-02-07 Jonas Köhler , Yaoyi Chen , Andreas Krämer , Cecilia Clementi , Frank Noé

We consider the problem of designing constraint-aware flow matching (FM) models that address the issue of constraint violations commonly observed in vanilla generative models. We consider two scenarios, viz.: (a) when a differentiable…

Machine Learning · Computer Science 2026-05-01 Zhengyan Huan , Jacob Boerma , Li-Ping Liu , Shuchin Aeron

Flow-based diffusion models have emerged as a leading paradigm for training generative models across images and videos. However, their memorization-generalization behavior remains poorly understood. In this work, we revisit the flow…

Machine Learning · Computer Science 2026-04-13 Haoming Liu , Jinnuo Liu , Yanhao Li , Liuyang Bai , Yunkai Ji , Yuanhe Guo , Shenji Wan , Hongyi Wen

Continuous-time generative models, such as Flow Matching (FM), construct probability paths to transport between one distribution and another through the simulation-free learning of the neural ordinary differential equations (ODEs). During…

Machine Learning · Computer Science 2024-05-24 Qunxi Zhu , Wei Lin

Sampling-based motion planning is the predominant paradigm in many real-world robotic applications, but its performance is immensely dependent on the quality of the samples. The majority of traditional planners are inefficient as they use…

Robotics · Computer Science 2020-10-23 Tin Lai , Fabio Ramos

Correlation filter (CF) has recently exhibited promising performance in visual object tracking for unmanned aerial vehicle (UAV). Such online learning method heavily depends on the quality of the training-set, yet complicated aerial…

Computer Vision and Pattern Recognition · Computer Science 2020-03-12 Fan Li , Changhong Fu , Fuling Lin , Yiming Li , Peng Lu

Normalizing flows provide an elegant method for obtaining tractable density estimates from distributions by using invertible transformations. The main challenge is to improve the expressivity of the models while keeping the invertibility…

Computer Vision and Pattern Recognition · Computer Science 2023-09-07 Avideep Mukherjee , Badri Narayan Patro , Vinay P. Namboodiri

Flow matching has emerged as a powerful generative framework, with recent few-step methods achieving remarkable inference acceleration. However, we identify a critical yet overlooked limitation: these models suffer from severe diversity…

Machine Learning · Computer Science 2026-04-15 Yexiong Lin , Jia Shi , Shanshan Ye , Wanyu Wang , Yu Yao , Tongliang Liu

In this work, we demonstrate how to reliably estimate epistemic uncertainty while maintaining the flexibility needed to capture complicated aleatoric distributions. To this end, we propose an ensemble of Normalizing Flows (NF), which are…

Machine Learning · Computer Science 2023-10-05 Lucas Berry , David Meger

Normalizing flows are a class of deep generative models that are especially interesting for modeling probability distributions in physics, where the exact likelihood of flows allows reweighting to known target energy functions and computing…

Machine Learning · Statistics 2023-11-27 Leon Klein , Andreas Krämer , Frank Noé

Diffusion models learn to denoise data and the trained denoiser is then used to generate new samples from the data distribution. In this paper, we revisit the diffusion sampling process and identify a fundamental cause of sample quality…

Machine Learning · Computer Science 2024-11-05 Yunshu Wu , Yingtao Luo , Xianghao Kong , Evangelos E. Papalexakis , Greg Ver Steeg

We apply a unified machine-learning framework based on Normalizing Flows (NFs) for the event-by-event reconstruction of invisible momenta and the subsequent evaluation of spin-sensitive observables in top-quark pair and dark-matter (DM)…

High Energy Physics - Phenomenology · Physics 2025-10-14 E. Abasov , L. Dudko , E. Iudin , A. Markina , P. Volkov , G. Vorotnikov , M. Perfilov , A. Zaborenko

Normalizing flows are a class of probabilistic generative models which allow for both fast density computation and efficient sampling and are effective at modelling complex distributions like images. A drawback among current methods is…

Computer Vision and Pattern Recognition · Computer Science 2020-10-28 Jason J. Yu , Konstantinos G. Derpanis , Marcus A. Brubaker

Diffusion and flow-matching models scale because pretraining is supervised regression: a clean sample is noised analytically, and a model regresses against a closed-form target. RL post-training aligns the model with a reward. In image…

Machine Learning · Computer Science 2026-05-19 Andreas Bergmeister , Stefanie Jegelka , Nikolas Nüsken , Carles Domingo-Enrich , Jakiw Pidstrigach

Flow matching has recently emerged as a promising alternative to diffusion-based generative models, particularly for text-to-image generation. Despite its flexibility in allowing arbitrary source distributions, most existing approaches rely…

Computer Vision and Pattern Recognition · Computer Science 2026-02-06 Junwan Kim , Jiho Park , Seonghu Jeon , Seungryong Kim

Reinforcement Learning (RL) has recently emerged as a powerful technique for improving image and video generation in Diffusion and Flow Matching models, specifically for enhancing output quality and alignment with prompts. A critical step…

Computer Vision and Pattern Recognition · Computer Science 2025-12-09 Feng Wang , Zihao Yu

Continuous normalizing flows (CNFs) and diffusion models (DMs) generate high-quality data from a noise distribution. However, their sampling process demands multiple iterations to solve an ordinary differential equation (ODE) with high…

Machine Learning · Computer Science 2025-11-19 Denis Gudovskiy , Wenzhao Zheng , Tomoyuki Okuno , Yohei Nakata , Kurt Keutzer

Conventional diffusion models typically relies on a fixed forward process, which implicitly defines complex marginal distributions over latent variables. This can often complicate the reverse process' task in learning generative…

Machine Learning · Statistics 2025-06-10 Grigory Bartosh , Dmitry Vetrov , Christian A. Naesseth

Normalizing Flows (NFs) are a classical family of likelihood-based methods that have received revived attention. Recent efforts such as TARFlow have shown that NFs are capable of achieving promising performance on image modeling tasks,…

Computer Vision and Pattern Recognition · Computer Science 2026-04-23 Tianrong Chen , Jiatao Gu , David Berthelot , Joshua Susskind , Shuangfei Zhai

We present an ultra-efficient post-training method for shortcutting large-scale pre-trained flow matching diffusion models into efficient few-step samplers, enabled by novel velocity field self-distillation. While shortcutting in flow…

Computer Vision and Pattern Recognition · Computer Science 2025-10-22 Xu Cai , Yang Wu , Qianli Chen , Haoran Wu , Lichuan Xiang , Hongkai Wen