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Related papers: Hessian-Informed Flow Matching

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This paper provides a formulation of the log-homotopy particle flow from the perspective of variational inference. We show that the transient density used to derive the particle flow follows a time-scaled trajectory of the Fisher-Rao…

Machine Learning · Statistics 2026-03-06 Yinzhuang Yi , Jorge Cortés , Nikolay Atanasov

Flow Matching (FM) underpins many state-of-the-art generative models, yet recent results indicate that Transition Matching (TM) can achieve higher quality with fewer sampling steps. This work answers the question of when and why TM…

Machine Learning · Computer Science 2026-05-22 Jaihoon Kim , Rajarshi Saha , Minhyuk Sung , Youngsuk Park

Training deep neural networks remains computationally intensive due to the itera2 tive nature of gradient-based optimization. We propose Gradient Flow Matching (GFM), a continuous-time modeling framework that treats neural network training…

Machine Learning · Computer Science 2025-05-27 Xiao Shou , Yanna Ding , Jianxi Gao

Flow Matching has recently gained attention in generative modeling as a simple and flexible alternative to diffusion models. While existing statistical guarantees adapt tools from the analysis of diffusion models, we take a different…

Machine Learning · Statistics 2026-03-18 Lea Kunkel , Mathias Trabs

A wealth of cosmological and astrophysical information is expected from many ongoing and upcoming large-scale surveys. It is crucial to prepare for these surveys now and develop tools that can efficiently extract most information. We…

High-fidelity Monte Carlo simulations and complex inverse problems, such as mapping smeared experimental observations to ground-truth states, are computationally intensive yet essential for robust data analysis. Conditional Flow Matching…

Machine Learning · Computer Science 2026-04-03 Zeyu Xia , Tyler Kim , Trevor Reed , Judy Fox , Geoffrey Fox , Adam Szczepaniak

Hybrid particle-field methods are computationally efficient approaches for modelling soft matter systems. So far applications of these methodologies have been limited to constant volume conditions. Here, we reformulate particle-field…

We introduce a new generative modeling framework, \textbf{Flow Matching with Arbitrary Auxiliary Paths (AuxPath-FM)}, which generalizes conditional flow matching by incorporating an auxiliary variable drawn from an arbitrary distribution…

Machine Learning · Computer Science 2026-05-08 Xin Peng , Ang Gao

Discrete diffusion and flow matching models capture complex, non-additive and non-autoregressive structure in high-dimensional objective landscapes through parallel, iterative refinement. However, their implicit generative nature precludes…

Machine Learning · Computer Science 2026-03-03 Yashvir S. Grewal , Daniel M. Steinberg , Thang D. Bui , Cheng Soon Ong , Edwin V. Bonilla

Energy-based models (EBMs) are versatile density estimation models that directly parameterize an unnormalized log density. Although very flexible, EBMs lack a specified normalization constant of the model, making the likelihood of the model…

Machine Learning · Computer Science 2024-02-20 Louis Grenioux , Éric Moulines , Marylou Gabrié

Functional data, i.e., smooth random functions observed over a continuous domain, are increasingly available in areas such as biomedical research, health informatics, and epidemiology. However, effective statistical analysis for functional…

Machine Learning · Statistics 2026-04-07 Jianbin Tan , Anru R. Zhang

This paper is concerned with probabilistic techniques for forecasting dynamical systems described by partial differential equations (such as, for example, the Navier-Stokes equations). In particular, it is investigating and comparing…

Machine Learning · Computer Science 2025-11-07 Hans Harder , Abhijeet Vishwasrao , Luca Guastoni , Ricardo Vinuesa , Sebastian Peitz

Classical Hamiltonian mechanics has been widely used in machine learning in the form of Hamiltonian Monte Carlo for applications with predetermined force fields. In this work, we explore the potential of deliberately designing force fields…

Machine Learning · Computer Science 2024-10-29 Peter Holderrieth , Yilun Xu , Tommi Jaakkola

Generative models, particularly normalizing flows, have shown exceptional performance in learning probability distributions across various domains of physics, including statistical mechanics, collider physics, and lattice field theory. In…

Strongly Correlated Electrons · Physics 2025-01-14 Dominic Schuh , Janik Kreit , Evan Berkowitz , Lena Funcke , Thomas Luu , Kim A. Nicoli , Marcel Rodekamp

The Holomorphic Embedding Load-Flow Method (HELM) was recently introduced as a novel technique to constructively solve the power-flow equations in power grids, based on advanced complex analysis. In this paper, the theoretical foundations…

Systems and Control · Computer Science 2015-09-09 Antonio Trias

Deep generative models have recently garnered significant attention across various fields, from physics to chemistry, where sampling from unnormalized Boltzmann-like distributions represents a fundamental challenge. In particular,…

Machine Learning · Computer Science 2025-06-09 Janik Kreit , Dominic Schuh , Kim A. Nicoli , Lena Funcke

Molecular structure generation is a fundamental problem that involves determining the 3D positions of molecules' constituents. It has crucial biological applications, such as molecular docking, protein folding, and molecular design. Recent…

Machine Learning · Computer Science 2025-08-27 Wenyin Zhou , Christopher Iliffe Sprague , Vsevolod Viliuga , Matteo Tadiello , Arne Elofsson , Hossein Azizpour

We extend the canonical problems of simulation and optimization of steady-state gas flows in pipeline networks with compressors to the transport of mixtures of highly heterogeneous gases injected throughout a network. Our study is motivated…

Optimization and Control · Mathematics 2022-12-05 Saif R. Kazi , Kaarthik Sundar , Shriram Srinivasan , Anatoly Zlotnik

The biological functions of proteins often depend on dynamic structural ensembles. In this work, we develop a flow-based generative modeling approach for learning and sampling the conformational landscapes of proteins. We repurpose highly…

Biomolecules · Quantitative Biology 2024-09-04 Bowen Jing , Bonnie Berger , Tommi Jaakkola

The Holomorphic Embedding Load flow Method (HELM) employs complex analysis to solve the load flow problem. It guarantees finding the correct solution when it exists, and identifying when a solution does not exist. The method, however, is…

Optimization and Control · Mathematics 2020-02-27 Majid Heidarifar , Panagiotis Andrianesis , Michael Caramanis
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