Optimal Transport

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23 papers in the last 28 days · 0.4% of indexed attention

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Period ending 2026-09-21

11 new papers

A weekly snapshot of new work published in Optimal Transport.

Period ending 2026-09-14

5 new papers

A weekly snapshot of new work published in Optimal Transport.

Period ending 2026-09-07

5 new papers

A weekly snapshot of new work published in Optimal Transport.

183 papers

Latest in Optimal Transport

May 18, 2026stat.ML

Geometric Dictionary Learning of Dynamical Systems with Optimal Transport

Learning dynamical systems through operator-theoretic representations provides a powerful framework for analyzing complex dynamics, as spectral quantities such as eigenvalues and invariant structures encode characteristic time scales and long-term behavior. However, dynamical operators are typically estimated independently for each system, preventing the discovery of shared structure across related dynamics. To address this limitation, we posit that related dynamical systems lie near a low-dimensional manifold in spectral operator space. Based on this hypothesis, we introduce DOODL (Dynamical OperatOr Dictionary Learning), a framework that learns a dictionary of characteristic spectral dynamics whose combinations approximate this manifold and yield compact, interpretable embeddings of individual systems. Beyond representation learning, DOODL enables fast and interpretable operator estimation from short and partially observed trajectories by constraining the estimation to the learned operator manifold. Experiments on metastable Langevin dynamics and turbulent plasma simulations demonstrate that DOODL scales to highly complex multiscale regimes while capturing characteristic spectral structure governing the dynamics rather than merely fitting trajectories, achieving errors one to two orders of magnitude lower than independent operator estimation methods in challenging low-data regimes.
Thibaut Germain, Sami Chemlal, Rémi Flamary +2
May 17, 2026cs.SD

A Distribution Matching Approach to Neural Piano Transcription with Optimal Transport

This paper describes a novel paradigm that formalizes automatic piano transcription (APT) as an optimal transport (OT) problem, not as a frame-level multi-label binary classification problem. Our method learns to minimize the cost of transporting a predicted distribution of note events to the ground-truth distribution over time and frequency. The OT loss can thus accommodate temporal misalignment, leading to perceptually relevant optimization. We also propose a convolutional recurrent neural network (CRNN) with a harmonics-aware attention mechanism to capture the spectro-temporal dependencies inherent in music.Our experiments using the MAESTRO dataset showed that our method attained a state-of-the-art performance in onset detection. We confirmed the versatility of the OT loss in application to existing models.
Weixing Wei, Raynaldi Lalang, Dichucheng Li +1
May 17, 2026math.OC

Scalable Bi-causal Optimal Transport via KL Relaxation and Policy Gradients

Bi-causal optimal transport (OT) is a natural framework for comparing and coupling stochastic processes under nonanticipative information constraints, with important applications in robust finance, sequential uncertainty quantification, and multistage stochastic optimization. In particular, a learned bi-causal coupling naturally serves as a simulator for generating joint sample paths that respect both prescribed marginal laws and the underlying information flow. Its practical use, however, is limited by the computational difficulty of enforcing bi-causal coupling constraints over path space, especially for continuous distributions and long horizons. We develop a scalable stochastic-optimization framework for computing bi-causal OT couplings under general marginals. Our approach introduces a Kullback--Leibler (KL)-penalized relaxation that replaces hard marginal constraints with tractable divergence penalties while preserving the recursive structure of the problem. We establish dynamic programming principles for both the original and relaxed formulations, prove that the relaxed problem converges to the original bi-causal OT problem as the penalty grows, and derive explicit policy-gradient representations for the relaxed objective. Building on these results, we propose a practical policy-gradient algorithm with unbiased mini-batch estimators, variance reduction, and nonasymptotic regret guarantees. Numerical experiments show that the method accurately captures marginal laws and temporal dependence, and performs well in applications including robust subhedging and time series statistical downscaling. These results provide a scalable computational approach to bi-causal OT and broaden its applicability in settings where nonanticipative information constraints are essential.
Haoyang Cao, Jesse Hoekstra, Renyuan Xu +2
May 16, 2026stat.ML

CAST: Causal Anchored Simplex Transport for Distribution-Valued Time Series

Many decision-facing stochastic systems are observed through aggregate distributions rather than scalar trajectories: queue occupancies, mobility shares, public-health mixtures, generation-source shares, ecological compositions, and air-quality severity profiles all live on the probability simplex and evolve over time. We study causal (online) forecasting for these distribution-valued time series and argue that the transition operator itself should be structured around the simplex. We introduce CAST (Causal Anchored Simplex Transport), a successor-local operator that (i) retrieves empirical successors from causal context, (ii) stabilizes them with a persistence anchor, and (iii) applies a bounded local stochastic transport on ordered supports; every stage preserves the simplex by construction. We identify a structural failure mode, latent transition-kernel aliasing, where similar observed distributions evolve differently under different contextual regimes, and prove that any forecaster depending only on an aliased summary incurs an irreducible weighted Jensen-Shannon excess-risk lower bound, while the CAST hypothesis class contains the regime-aware Bayes successor; for ordered supports an additional Pinsker separation holds whenever the transported successor lies outside the no-transport anchor hull. On eleven public and simulated benchmarks spanning ecology, energy, diet, mortality, employment, air quality, severe weather, mobility, and G/G/1, G_t/G/1 queue occupancy, CAST attains the best average rank on both one-step KL (1.27) and autoregressive rollout JSD (1.91), winning 8/11 sections on each metric against a broad statistical, compositional, recurrent, convolutional, and Transformer baseline set, and top-2 on all 11 sections for offline KL. Component ablations and a controlled synthetic aliasing experiment corroborate the theory.
Jiecheng Lu, Jieqi Di, Runhua Wu +1
May 15, 2026cs.LG

Multiscale Supervised Unbalanced Optimal Transport Flow Matching

Unbalanced optimal transport (UOT) provides a principled framework for modeling single-cell transitions and birth-death dynamics, but its high computational cost limits scalability to large-scale datasets. Although single-cell data often contain hierarchical annotations and known transition priors, existing UOT approximations rarely exploit this multiscale structure or prior knowledge. We introduce Multiscale Supervised Unbalanced Optimal Transport Flow Matching (MUST-FM), a simulation-free framework that scales UOT by leveraging hierarchical data structure. MUST-FM further supports an optional supervised formulation that incorporates transition priors, such as cell lineages, to guide the learning of displacement fields and mass variations. Experiments show that MUST-FM reduces computational overhead while achieving robust and biologically meaningful trajectory inference, enabling dynamic modeling of atlas-scale single-cell datasets.
Qiangwei Peng, Lezhi Chen, Peijie Zhou
May 15, 2026cs.GR

StippleDiffusion: Capacity-Constrained Stippling using Controlled Diffusion

Stipple patterns, point sets whose local density tracks a target image, are traditionally produced by per-density iterative optimizers, which are slow, non-differentiable, and must be re-run from scratch for each new target. Learned alternatives have so far addressed only unconditional point generation; capacity-constrained, image-conditioned stippling has remained out of reach. We present the first diffusion-based sampler that simultaneously satisfies a learned local point-distribution prior and a continuous, image-defined capacity constraint at inference. The method is a ControlNet branch built on top of an optimal-transport-grid point-set diffusion baseline, conditioned on the target density map and a high-resolution image. Two design choices make the combination tractable: training and inference are restricted to the late-stage denoising regime, initialized from a density-weighted rejection sample, and the standard zero-convolution injection is replaced with a sigmoid-gated 1x1 projection that preserves the base model's blue-noise structure under hard density signals. A single trained checkpoint accepts arbitrary target densities at inference, generalizes to point budgets that were not seen during training, and produces stipples in time nearly independent of the output point count. On the Icons-50 benchmark, our learned sampler reaches parity with per-density-optimized baselines on every reported metric while remaining differentiable end-to-end.
Ofir Gilad, Aleksander Plocharski, Przemyslaw Musialski +1
May 14, 2026cs.LG

Lagrangian Flow Matching: A Least-Action Framework for Principled Path Design

Flow matching trains a neural velocity field by regression against a target velocity associated with a prescribed probability path connecting a simple initial distribution to the data distribution. A central design choice is the path itself. Existing constructions, including rectified and optimal-transport-based paths, transport samples along straight lines between coupled endpoints and thus cover only a narrow class of dynamics. We observe that this corresponds to the simplest case of the least-action principle in classical mechanics, in which the kinetic Lagrangian yields free-particle straight-line trajectories. Building on this observation, we propose Lagrangian flow matching, a physics-based framework in which the probability path and velocity field are determined by minimizing the action of a general Lagrangian subject to the continuity equation and the prescribed endpoints. We show that this dynamic problem admits an equivalent static optimal transport (OT) formulation, yielding a family of simulation-free training objectives that recover OT-based flow matching as the kinetic special case and the trigonometric variance-preserving diffusion path as the harmonic-oscillator case. More general Lagrangians give rise to new probability paths and velocity fields, and numerical experiments show that they induce meaningful changes in the learned dynamics while remaining competitive with existing conditional flow matching models.
Shukai Du, Junzhe Zhang, Yiming Li
May 13, 2026cs.LG

WarmPrior: Straightening Flow-Matching Policies with Temporal Priors

Generative policies based on diffusion and flow matching have become a dominant paradigm for visuomotor robotic control. We show that replacing the standard Gaussian source distribution with WarmPrior, a simple temporally grounded prior constructed from readily available recent action history, consistently improves success rates on robotic manipulation tasks. We trace this gain to markedly straighter probability paths, echoing the effect of optimal-transport couplings in Rectified Flow. Beyond standard behavior cloning, WarmPrior also reshapes the exploration distribution in prior-space reinforcement learning, improving both sample efficiency and final performance. Collectively, these results identify the source distribution as an important and underexplored design axis in generative robot control.
Sinjae Kang, Chanyoung Kim, Kaixin Wang +2
May 13, 2026cs.LG

Min Generalized Sliced Gromov Wasserstein: A Scalable Path to Gromov Wasserstein

We propose min Generalized Sliced Gromov--Wasserstein (min-GSGW), a sliced formulation for the Gromov--Wasserstein (GW) problem using expressive generalized slicers. The key idea is to learn coupled nonlinear slicers that assign compatible push-forward values to both input measures, so that monotone coupling in the projected domain lifts to a transport plan evaluated against the GW objective in the original spaces. The resulting plan induces a GW objective value, and min-GSGW minimizes this cost directly in the original spaces. We further show that min-GSGW is rigid-motion invariant, a crucial property for geometric matching and shape analysis tasks. Our contributions are threefold: 1) we introduce generalized slicers into the sliced GW framework, 2) we construct a slicing-based efficient GW transport plan; and 3) we develop an amortized variant that replaces per-instance optimization with a learned slicer for unseen input pairs. We perform experiments on animal mesh matching, horse mesh interpolation, and ShapeNet part transfer. Results show that min-GSGW produces meaningful geometric correspondences and GW objective values at substantially lower computational cost than existing GW solvers.
Ashkan Shahbazi, Xinran Liu, Ping He +1
May 13, 2026stat.ML

Coupling-Informed Transport Maps for Bayesian Filtering in Nonlinear Dynamical Systems

A likelihood-free transport filtering method is proposed based on the couplings between state and observation variables. By exploiting a block-triangular structure in the transport map, the analysis step of filtering is reformulated as the minimization of the maximum mean discrepancy (MMD) between the true joint measure and its transport-based approximation. To circumvent the non-convexity in the MMD optimization, we introduce a training-free transport filter method via gradient flows, which leads to an analytic computation for the transport map that implies the steepest descent direction of the MMD. The proposed approach accurately approximates non-Gaussian filtering posteriors and avoids particle collapse. We provide a convergence analysis for the expectation of the MMD between the approximated posterior and the truth posterior. Finally, we extend the method to high-dimensional problems through domain localization. Numerical examples demonstrate the superior performance of our approach over conventional filtering methods in nonlinear, non-Gaussian scenarios.
Dengfei Zeng, Lijian Jiang, Shuyu Sun +1
May 13, 2026cs.CV

Pareto-Guided Optimal Transport for Multi-Reward Alignment

Text-to-image generation models have achieved remarkable progress in preference optimization, yet achieving robust alignment across diverse reward models remains a significant challenge. Existing multi-reward fusion approaches rely on weighted summation, which is costly to tune and insufficient for balancing conflicting objectives. More critically, optimization with reward models is highly susceptible to reward hacking, where reward scores increase while the perceived quality of generated images deteriorates. We demonstrate that optimizing against a unified global target under heterogeneous reward upper bounds can induce reward hacking, a risk further exacerbated by the inherent instability of weak reward models. To mitigate this, we propose a Pareto Frontier-Guided Optimal Transport (PG-OT) framework. Our method constructs a prompt-specific Pareto frontier and maps dominated samples toward it via distribution-aware optimal transport. Furthermore, we develop both online and offline optimization strategies tailored to diverse reward signal characteristics. To provide a more rigorous assessment, we introduce the Joint Domination Rate (JDR) and Joint Collapse Rate (JCR) as principled metrics to quantify multi-reward synergy and reward hacking. Experimental results show that our approach outperforms strong baselines with an 11% gain in JDR and achieves a near 80% win rate in human evaluations.
Ying Ba, Tianyu Zhang, Mohan Zhou +5
May 12, 2026cs.LG

IGT-OMD: Implicit Gradient Transport for Decision-Focused Learning under Delayed Feedback

Decision-focused learning trains predictive models end-to-end against downstream decision loss, but online settings suffer delayed feedback: outcomes may not arrive for many environment interactions. We identify \emph{staleness amplification}, a failure mode unique to bilevel optimization under delay, in which gradient staleness couples with inner-solver sensitivity to inflate regret beyond single-level delay theory. We prove that any black-box delayed optimizer incurs an irreducible regret cost from inner-solver approximation error, and that gradient staleness contributes a quadratically growing transport error without bilevel-aware correction. Our algorithm, \textbf{IGT-OMD}, applies Implicit Gradient Transport to hypergradients within Online Mirror Descent, re-evaluating stale gradients at the current parameters using stored inner solutions. This method reduces transport error from a quadratic to a linear dependence on delay and achieves the first sublinear regret bound for delayed bilevel optimization with queue-length-adaptive step sizes. Controlled experiments provide a \emph{mechanistic fingerprint}: transport benefit is exactly 0.0%0.0\% (p=1.00p=1.00) at unit delay and grows monotonically to 9.5%9.5\% at fifty rounds (p<0.001p<0.001), isolating the correction's effect. On Linear Quadratic Regulator, Warcraft shortest-path, and Sinkhorn optimal transport, IGT-OMD reduces decision loss by 1717--55%55\% relative to single-level baselines, with phase transitions matching the theory.
Benjamin Amoh, Geoffrey G. Parker, Wesley Marrero
May 12, 2026cs.LG

Expected Batch Optimal Transport Plans and Consequences for Flow Matching

Solving optimal transport (OT) on random minibatches is a common surrogate for exact OT in large-scale learning. In flow matching (FM), this surrogate is used to obtain OT-like couplings that can straighten probability paths and reduce numerical integration cost. Yet, the population-level coupling induced by repeated minibatch OT remains only partially understood. We formalize this coupling as the expected batch OT plan πk\overlineπ_{k}, obtained by averaging empirical OT plans over independent minibatches of size kk. We then establish its large-batch consistency and, in the semidiscrete case relevant to generative modeling, derive rates for both the transport-cost bias and the convergence of πk\overlineπ_{k} to the OT plan. For FM, this yields a population coupling whose induced velocity field is regular enough to define a unique flow from the source to the discrete target. We finally quantify how OT batch size interacts with numerical integration in a tractable two-atom model and in synthetic and image experiments.
Samuel Boïté, Julie Delon, Kimia Nadjahi
May 12, 2026cs.LG

QDSB: Quantized Diffusion Schrödinger Bridges

Learning generative models in settings where the source and target distributions are only specified through unpaired samples is gaining in importance. Here, one frequently-used model are Schrödinger bridges (SB), which represent the most likely evolution between both endpoint distributions. To accelerate training, simulation-free SBs avoid the path simulation of the original SB models. However, learning simulation-free SBs requires paired data; a coupling of the source and target samples is obtained as the solution of the entropic optimal transport (OT) problem. As obtaining the optimal global coupling is infeasible in many practical cases, the entropic OT problem is iteratively solved on minibatches instead. Still, the repeated cost remains substantial and the locality can distort the global transport geometry. We propose quantized diffusion Schrödinger bridges (QDSB), which compute the endpoint coupling on anchor-quantized endpoint distributions and lift the resulting plan back to original data points through cell-wise sampling. We show that the regularized optimal coupling is stable w.r.t. anchor quantization, with an error controlled by the quality of the anchor approximation. In real-world experiments, QDSB matches the sample quality of existing baselines, requiring substantially less time. Code and data are available at github.com/mathefuchs/qdsb.
Tobias Fuchs, Florian Kalinke, Nadja Klein
May 11, 2026cs.LG

Optimal and Scalable MAPF via Multi-Marginal Optimal Transport and Schrödinger Bridges

We consider anonymous multi-agent path finding (MAPF) where a set of robots is tasked to travel to a set of targets on a finite, connected graph. We show that MAPF can be cast as a special class of multi-marginal optimal transport (MMOT) problems with an underlying Markovian structure, under which the exponentially large MMOT collapses to a linear program (LP) polynomial in size. Focusing on the anonymous setting, we establish conditions under which the corresponding LP is feasible, totally unimodular, and consequently, yields min-cost, integral ({0,1})(\{0,1\}) transports that do not overlap in both space and time. To adapt the approach to large-scale problems, we cast the MAPF-MMOT in a probabilistic framework via Schrödinger bridges. Under standard assumptions, we show that the Schrödinger bridge formulation reduces to an entropic regularization of the corresponding MMOT that admits an iterative Sinkhorn-type solution. The Schrödinger bridge, being a probabilistic framework, provides a shadow (fractional) transport that we use as a template to solve a reduced LP and demonstrate that it results in near-optimal, integral transports at a significant reduction in complexity. Extensive experiments highlight the optimality and scalability of the proposed approaches.
Usman A. Khan, Joseph W. Durham
May 11, 2026math.OC

Implicit Neural Optimal Transport via Fixed-Point Optimization

We propose an implicit neural formulation of optimal transport that eliminates adversarial min--max optimization and multi-network architectures commonly used in existing approaches. Our key idea is to parameterize a single potential in the Kantorovich dual and reformulate the associated c-transform as a proximal fixed-point problem. This yields a stable single-network framework in which dual feasibility is enforced exactly through proximal optimality conditions rather than adversarial training. Despite the inner fixed-point computation, gradients can be computed without differentiating through the fixed-point iterations, enabling efficient training without requiring implicit differentiation. We further establish convergence of stochastic gradient descent. The resulting framework is efficient, scalable, and broadly applicable: it simultaneously recovers forward and backward transport maps and naturally extends to class-conditional settings. Experiments on high-dimensional Gaussian benchmarks, physical datasets, and image translation tasks demonstrate strong transport accuracy together with improved training stability and favorable computational and memory efficiency.
Yesom Park, Eric Gelphman, Stanley Osher +1
May 11, 2026math.MG

The Observable Wasserstein Distance

We introduce the observable Wasserstein distance, a framework for deriving lower bounds on the Wasserstein distance between probability measures on Polish metric spaces, designed to bypass the computational intractability of exact optimal transport in large-scale, non-Euclidean datasets. Analogous to the sliced Wasserstein distance in Rd\mathbb{R}^d, our approach projects measures onto the real line via 1-Lipschitz observables and computes the Wasserstein distances between the resulting pushforward distributions. We define a hierarchy of pseudo-metrics by restricting observables to a nested chain of subspaces. A central theoretical contribution is an injectivity result linking the metric covering dimension of the support of a measure to the specific order in the hierarchy that guarantees unique recovery. This serves as a metric-space analogue to the Cramér-Wold Device for Euclidean distributions. We demonstrate that this hierarchy offers a tunable trade-off between sharpness as a lower bound on the Wasserstein distance and computational efficiency. We also present a discrete computational model for finite grids and numerical experiments validating the efficacy and utility of these approximations.
Edivaldo Lopes dos Santos, Leandro Vicente Mauri, Washington Mio +1
May 10, 2026cs.LG

Neural Cluster First, Route Second: One-Shot Capacitated Vehicle Routing via Differentiable Optimal Transport

The Capacitated Vehicle Routing Problem (CVRP) underpins modern last-mile logistics. Current Neural Combinatorial Optimization (NCO) methods construct CVRP solutions autoregressively, inheriting sequential decoding bottlenecks, sensitivity to spatial symmetries, and brittle out-of-distribution behavior. We revisit the classical Cluster-First-Route-Second (CFRS) paradigm -- long known to be asymptotically optimal but largely overlooked by NCO -- and argue that it is structurally aligned with the core strengths of deep learning: similarity and assignment over global context, rather than the construction of long sequential tours. We introduce Neural CFRS, the first purely non-autoregressive one-shot neural CFRS framework for the CVRP. It enforces global fleet-capacity constraints end-to-end via a differentiable entropic Optimal Transport layer, producing a continuous transport plan to sparsify an exact capacitated assignment solver. We provide formal theoretical guarantees that our architecture intrinsically abstracts away E(2)E(2) spatial, inter-route permutation, and intra-route traversal symmetries. By equipping the framework with a pre-trained spatial vocabulary, we unlock extreme parameter efficiency and zero-shot scaling. Designed primarily for real-world spatial distributions under a constant capacity setting, Neural CFRS scales robustly to out-of-distribution N=1000N=1000 instances with a < 4% gap -- retaining an approximate 5% gap at this scale even as an ultra-lightweight, single-layer architecture. Furthermore, when deployed out-of-the-box on standard benchmarks, we achieve a highly competitive 2.73% optimality gap on size-100 problems.
Samuel J. K. Chin, Maximilian Schiffer
May 9, 2026eess.SY

Transfer Learning of Multiobjective Indirect Low-Thrust Trajectories Using Diffusion Models and Markov Chain Monte Carlo

Preliminary low-thrust spacecraft mission design is a global search problem characterized by a complex solution landscape, multiple objectives, and numerous local minima. During this phase, mission parameters are often not yet fully defined, requiring new solutions to be generated at a high cadence across varying parameter values. When combined with the indirect approach to optimal control, diffusion models can accelerate this search by learning distributions that represent high-quality initial costates. However, generating training data remains expensive, and opportunities exist to better exploit past data. We propose a transfer-learning framework that combines homotopy in a mission parameter with Markov chain Monte Carlo (MCMC) to generate training data more efficiently. The approach reformulates a multiobjective optimization problem as sampling from an unnormalized target distribution in costate space. We compare three MCMC algorithms on a planar multi-revolution transfer in the circular restricted three-body problem, with homotopy in the system mass parameter. The results show that gradient-based MCMC variants achieve the best trade-off between sample quality and computational cost. For the test transfer, the proposed framework generates 40 % more feasible solutions and achieves a higher-quality Pareto front than a state-of-the-art indirect approach based on adjoint control transformations and gradient-based optimization. Finally, the MCMC-generated samples are used to fine-tune a diffusion model conditioned on the mass parameter, enabling it to learn a global representation of the underlying solution distribution and efficiently generate new solutions. These findings establish the transfer-learning framework as a practical method for efficiently solving indirect trajectory optimization problems with varying parameters.
Jannik Graebner, Ryne Beeson
May 9, 2026cs.CV

Geometrically Constrained Stenosis Editing in Coronary Angiography via Entropic Optimal Transport

The scarcity of high-quality imaging data for coronary angiography (CAG) stenosis limits the clinical translation of automated stenosis detection. Synthetic stenosis data provides a practical avenue to augment training sets, improving data quality, diversity, and distributional coverage, and enhancing detection precision and generalization. However, diffusion-based editing commonly relies on soft guidance in a noise-initialized reverse process, offering limited pixel-level precision and structure preservation. We propose the OT-Bridge Editor, which reframes localized editing as a constrained entropic optimal transport (OT) problem and leverages geometric information to steer the generation path, enabling stronger geometric control. Extensive experiments show that our synthesized angiograms consistently improve downstream stenosis detection, yielding substantial relative gains of 27.8% on the public ARCADE benchmark and 23.0% on our multi-center dataset, supported by consistent qualitative results.
Jialin Li, Zhuo Zhang, Yue Cao +4
May 9, 2026cs.MS

cuRegOT: A GPU-Accelerated Solver for Entropic-Regularized Optimal Transport

Optimal transport (OT) has emerged as a fundamental tool in modern machine learning, yet its computational cost remains a significant bottleneck for large-scale applications. While harnessing the massive parallelism of modern GPU hardware is critical for efficiency, the de facto standard Sinkhorn algorithm, despite its ease of parallelization, often suffers from slow convergence in challenging problems. More recently, the sparse-plus-low-rank quasi-Newton method offers a balance between convergence rate and per-iteration complexity; however, its efficiency on GPUs is severely hindered by the serial nature of sparse matrix symbolic analysis and irregular memory access patterns. To bridge this gap, we present cuRegOT, a high-performance GPU solver tailored for entropic-regularized OT. We introduce a suite of algorithmic and architectural optimizations, including an amortized symbolic analysis strategy to mitigate CPU bottlenecks, an asynchronous Sinkhorn iterates generation mechanism, and a fused kernel for bandwidth-efficient gradient evaluation. These strategies are backed by rigorous theoretical guarantees ensuring algorithmic convergence. Extensive numerical experiments demonstrate that cuRegOT achieves significant speedups over state-of-the-art GPU-based solvers across a variety of benchmark tasks.
Yixuan Qiu
May 8, 2026stat.ML

Sinkhorn Treatment Effects: A Causal Optimal Transport Measure

We introduce the Sinkhorn treatment effect, an entropic optimal transport measure of divergence between counterfactual distributions. Unlike classical quantities such as the average treatment effect, this measure captures differences across entire distributions. We analyze this divergence as a statistical functional and show it can be written as a smooth transformation of counterfactual mean embeddings with an appropriate kernel. This characterization allows us to establish first-order pathwise differentiability in general, and second-order pathwise differentiability under the null hypothesis of equal counterfactual distributions. Leveraging this smoothness, we construct debiased estimators and use them to obtain asymptotically valid tests for distributional treatment effects with a fixed entropic regularization parameter. Because the power of the test depends on this unknown parameter, we further propose an aggregated test that combines evidence across a grid of regularization choices. Experiments on simulated and image data demonstrate the practical advantages of our estimator and testing procedure.
Medha Agarwal, Alex Luedtke
May 8, 2026cs.LG

Tessellations of Semi-Discrete Flow Matching

We study Flow Matching in a semi-discrete setting where a Gaussian source is transported toward a discrete target supported on finitely many points. This semi-discrete regime is the theoretical setting behind the use of Flow Matching for generative modeling, where the target distribution is represented by a finite dataset. In this semi-discrete regime, the exact Flow Matching velocity field is available in closed form, which makes it possible to analyze the geometry induced by the terminal flow map independently of optimization and approximation effects. We investigate the terminal assignment regions, namely the preimages of the target atoms under the terminal flow. We show that these regions are open, simply connected and, under an additional assumption, homeomorphic to the unit ball. At the same time, a planar four-point example shows that these cells can differ sharply from Laguerre cells arising in semi-discrete optimal transport: they may be non-convex, have curved boundaries, and exhibit different boundedness and adjacency patterns. These results clarify the geometry intrinsically induced by the exact semi-discrete Flow Matching objective before neural approximation enters the picture.
Emile Pierret, Johannes Hertrich, Samuel Hurault +1
May 8, 2026stat.ML

TRACE: Transport Alignment Conformal Prediction via Diffusion and Flow Matching Models

Constructing valid and informative conformal prediction regions for multi-dimensional outputs remains a fundamental challenge. While conformal prediction provides finite-sample, distribution-free coverage guarantees, its practical performance critically depends on the choice of nonconformity score. Existing approaches often rely on restrictive geometric assumptions or require explicit likelihood evaluation and invertible transformations, limiting their applicability in complex generative settings. In this work, we introduce TRACE (TRansport Alignment Conformal Estimation), a conformal prediction framework that defines nonconformity through transport alignment in diffusion and flow matching models. Rather than evaluating likelihoods, we measure how well a candidate output aligns with the learned generative dynamics by averaging denoising or velocity-matching errors along stochastic transport trajectories. The resulting transport-based scores are scalar-valued and can be calibrated using split conformal prediction, yielding valid marginal coverage under exchangeability. We further analyze the statistical properties of the proposed scores and their sensitivity to computational budget. Experiments on synthetic and real datasets demonstrate valid coverage and show that the resulting regions adapt naturally to multimodal and non-convex conditional distributions.
Zhenhan Fang, Aixin Tan, Jian Huang
May 7, 2026cs.LG

PLOT: Progressive Localization via Optimal Transport in Neural Causal Abstraction

Causal abstraction offers a principled framework for mechanistic interpretability, aligning a high-level causal model with the low-level computation realized by a neural network through counterfactual intervention analysis. Existing methods such as distributed alignment search (DAS) learn expressive subspace interventions, but the relevant neural site is unknown a priori, so finding a handle requires a computationally burdensome search over candidate sites. We introduce PLOT (Progressive Localization via Optimal Transport), a transport-based framework that localizes causal variables from the output effect geometry of abstract and neural interventions. PLOT fits an optimal transport coupling between abstract variables and candidate neural sites, yielding a global soft correspondence that can be calibrated into intervention handles. In simple settings, a single coupling over individual neurons suffices. In larger models, PLOT is applied progressively, moving from coarse sites such as tokens, timesteps, or layers to finer supports such as coordinate groups or PCA spans, and optionally guiding DAS based on the localized signal. Across experiments of increasing complexity, transport-only PLOT handles are exceedingly fast and competitive on accuracy, while PLOT-guided DAS reaches DAS-level accuracy at a fraction of full DAS runtime, providing an efficient localization engine for causal abstraction research at scale.
Jonathn Chang, Arya Datla, Ziv Goldfeld
May 7, 2026cs.LG

Distributional Process Reward Models: Calibrated Prediction of Future Rewards via Conditional Optimal Transport

Inference-time scaling methods rely on Process Reward Models (PRMs), which are often poorly calibrated and overestimate success probabilities. We propose, to our knowledge, the first use of conditional optimal transport for calibrating PRMs, modifying conditional OT (CondOT) map learning \cite{bunne2022supervised} to estimate a monotonic conditional quantile function over success probabilities estimated by the PRM, conditioned on PRM hidden states. This yields structurally valid quantile estimates and enables efficient extraction of confidence bounds at arbitrary levels, which we integrate into the instance-adaptive scaling (IAS) framework of \cite{park2025know}. We evaluate on mathematical reasoning benchmarks spanning moderate-difficulty problems (MATH-500) and harder out-of-distribution problems (AIME). For PRMs with reliable ranking signals, our method substantially improves calibration over both uncalibrated PRMs and quantile regression. On downstream Best-of-N IAS performance, our method generally improves over uncalibrated PRMs. These results establish conditional optimal transport as another principled and practical approach to PRM calibration, offering structural guarantees and flexible uncertainty estimation.
Rachel Ma, Dylan Hadfield-Menell, Kristjan Greenewald
May 7, 2026stat.ML

Expressivity of Bi-Lipschitz Normalizing Flows: A Score-Based Diffusion Perspective

Many normalizing flow architectures impose regularity constraints, yet their distributional approximation properties are not fully characterized. We study the expressivity of bi-Lipschitz normalizing flows through the lens of score-based diffusion models. For the probability flow ODE of a variance-preserving diffusion, Lipschitz regularity of the score induces a flow of bi-Lipschitz diffeomorphic transport maps. This ODE bridge allows us to analyze the distributional approximation power of bi-Lipschitz normalizing flows and, conversely, derive deterministic convergence guarantees for diffusion-based transport. Our key idea is to use the probability flow ODE to link regularity of the score to regularity of the induced transport maps. We verify score regularity for broad target densities, including compactly supported densities, Gaussian convolutions of compactly supported measures and finite Gaussian mixtures. We obtain a universal distributional approximation result: Gaussian pullbacks induced by bi-Lipschitz variance-preserving transport maps are L1L^1-dense among all probability densities. For Gaussian convolution targets, we further obtain convergence in Kullback-Leibler divergence without early stopping.
Meira Iske, Carola-Bibiane Schönlieb
May 7, 2026cs.LG

Optimal Transport for LLM Reward Modeling from Noisy Preference

Reward models are fundamental to Reinforcement Learning from Human Feedback (RLHF), yet real-world datasets are inevitably corrupted by noisy preference. Conventional training objectives tend to overfit these errors, while existing denoising approaches often rely on homogeneous noise assumptions that fail to capture the complexity of linguistic preferences. To handle these challenges, we propose SelectiveRM, a framework grounded in optimal transport. We first devise a Joint Consistency Discrepancy to align the distribution of model predictions with preference data. Furthermore, to address the limitation of strict mass conservation which compels the model to fit outliers, we incorporate a Mass Relaxation mechanism via partial transport. This enables the autonomous exclusion of samples with noisy preference that contradict semantic consistency. Theoretically, we demonstrate that SelectiveRM optimizes a tighter upper bound on the unobserved clean risk. Extensive experiments validate that our approach significantly outperforms state-of-the-art baselines across diverse benchmarks.
Licheng Pan, Haochen Yang, Haoxuan Li +8
May 7, 2026cs.LG

Accelerating LMO-Based Optimization via Implicit Gradient Transport

Recent optimizers such as Lion and Muon have demonstrated strong empirical performance by normalizing gradient momentum via linear minimization oracles (LMOs). While variance reduction has been explored to accelerate LMO-based methods, it typically incurs substantial computational overhead due to additional gradient evaluations. At the same time, the theoretical understanding of LMO-based methods remains fragmented across unconstrained and constrained formulations. Motivated by these limitations, we propose \emph{LMO-IGT}, a new class of stochastic LMO-based methods leveraging implicit gradient transport (IGT). We further introduce a unified framework for stochastic LMO-based optimization together with a new stationarity measure, the \emph{regularized support function} (RSF), which bridges gradient-norm and Frank--Wolfe-gap notions within a common framework. By evaluating stochastic gradients at transported points, LMO-IGT accelerates convergence while retaining the single-gradient-per-iteration structure of standard stochastic LMO. Our analysis establishes that stochastic LMO achieves an iteration complexity of O(ε4)\mathcal{O}(\varepsilon^{-4}), variance-reduced LMO achieves O(ε3)\mathcal{O}(\varepsilon^{-3}) at the cost of additional gradient evaluations, and LMO-IGT achieves O(ε3.5)\mathcal{O}(\varepsilon^{-3.5}) using only a single stochastic gradient per iteration. Empirically, LMO-IGT consistently improves over stochastic LMO counterparts with negligible overhead. Among its instantiations, Muon-IGT achieves the strongest overall performance across evaluated settings, demonstrating that IGT provides an effective and practical acceleration mechanism for modern LMO-based optimization.
Won-Jun Jang, Si-Hyeon Lee
May 7, 2026math.OC

Stability of the Monge Map in Semi-Dual Optimal Transport

This paper shows that the semi-dual formulation of the optimal transport problem has a degenerate saddle-point structure, and that its numerical solution is equivalent to solving a constrained optimization problem. We derive necessary and sufficient conditions for the convergence of Monge maps without requiring optimality of the dual potential. This analysis helps explain why, in practice, numerical algorithms often require more iterations to update the transport map than the potential.
Anton Selitskiy, David Millard
May 7, 2026eess.AS

Optimal Transport Audio Distance with Learned Riemannian Ground Metrics

In audio generation evaluation, Fréchet Audio Distance (FAD) is a 2-Wasserstein distance with structural constraints for both primitives: the cost is a frozen embedding pullback whose invariance set hides severe artifacts, and the coupling is a Gaussian fit that dilutes rank-1 contamination relative to discrete OT. We propose Optimal Transport Audio Distance (OTAD), which corrects each primitive with one dedicated mechanism -- a residual Riemannian ground-metric adapter for the cost and entropic Sinkhorn optimal transport for the coupling. Across eight encoders under a four-axis protocol, coupling-only comparisons at ε=0.05ε= 0.05 show that Sinkhorn's rank-1 sensitivity exceeds FAD's by a factor of 1.9 to 3.6. Furthermore, OTAD achieves a higher mean Spearman correlation with audio-quality MOS (DCASE 2023 Task 7) than baseline metrics. As an intrinsic benefit of the discrete transport plan, OTAD yields per-sample diagnostics with AUROC 0.86\ge 0.86, a capability that scalar- or kernel-aggregated metrics structurally lack.
Wonwoo Jeong
May 6, 2026cs.LG

Reliable Modeling of Distribution Shifts via Displacement-Reshaped Optimal Transport

Optimal transport (OT) is a central framework for modeling distribution shifts. Because OT compares distributions directly in input space, a well-designed ground metric between observations is essential to ensure that the optimizer does not violate the true geometry of change. We propose Displacement-Reshaped Optimal Transport (ReshapeOT), a method that reshapes the ground metric by integrating observed sample displacements as an additional source of knowledge. Technically, ReshapeOT replaces the Euclidean metric with a Mahalanobis distance estimated from displacement second moments. This effectively carves expressways through the input space, inviting transport solutions that better align with observed displacements. Our method is computationally lightweight, integrates seamlessly into any OT solver that operates on a cost matrix, and can be kernelized for further flexibility. Experiments on synthetic and real-world data show that ReshapeOT achieves substantial gains in transport reliability. We further demonstrate our method's usefulness in two practical use cases.
Philip Naumann, Jacob Kauffmann, Klaus-Robert Müller +1
May 6, 2026cs.LG

Discovering Sparse Counterfactual Factors via Latent Adjustment for Survey-based Community Intervention

Transportation surveys are widely used to understand travel preferences and adoption barriers, yet most survey-based analyses remain descriptive or predictive and rarely provide sparse, policy-feasible intervention strategies. We study sparse counterfactual community intervention from survey responses, where the goal is to shift a target respondent group toward a desired reference group through controllable survey-variable adjustments. We formulate this task as a policy-feasible distributional alignment problem using a fixed-basis nonnegative latent representation that preserves pre/post comparability and provides a stable map from latent factors to original variables. To make latent movement actionable, target-relevant latent factors are identified through Shapley-guided attribution and transferred to controllable variables as intervention priorities. Feasible group-level adjustments are then learned by minimizing an entropy-regularized optimal-transport discrepancy between the post-intervention target distribution and the reference distribution, together with a weighted 2,1\ell_{2,1} penalty that promotes shared policy-lever sparsity. Experiments on real-world transportation survey datasets show that the proposed framework produces compact and interpretable policy-feasible interventions with explicit adjustment magnitudes, improves population-level conversion, and preserves intervention sparsity. Code and datasets are publicly available at: https://github.com/pangjunbiao/latent-group-alignment.git
Fatima Ashraf, Muhammad Ayub Sabir, Junbiao Pang +2
May 5, 2026stat.ML

Entropic Riemannian Neural Optimal Transport

Many machine learning problems involve data supported on curved spaces such as spheres, rotation groups, hyperbolic spaces, and general Riemannian manifolds, where Euclidean geometry can distort distances, averages, and the resulting optimal transport (OT) problem. Existing manifold OT methods have pursued amortized out-of-sample maps, while entropic regularization has made discrete OT more scalable, but these advantages have remained largely disjoint. We propose Entropic Riemannian Neural Optimal Transport (Entropic RNOT), a unified framework that combines intrinsic entropic OT with amortized out-of-sample evaluation on Riemannian manifolds. Our method learns a single target-side Schrödinger potential through a neural pullback parameterization, recovers the induced Gibbs coupling, and uses the resulting conditional laws to construct intrinsic transport surrogates. These include barycentric projections on Cartan-Hadamard manifolds and heat-smoothed conditional surrogates on stochastically complete manifolds, the latter turning possibly atomic target laws into absolutely continuous ones. For fixed regularization ε>0\varepsilon>0, we prove that the proposed hypothesis class recovers the entropic optimal coupling in strong probabilistic metrics. As consequences, barycentric surrogates converge in L2L^2, while heat-smoothed surrogates are stable at fixed heat time and asymptotically unbiased as the heat time vanishes. The guarantees hold for compactly supported data on possibly noncompact manifolds. Empirically, our method matches or improves over Euclidean, tangent-space, and log-Euclidean baselines on benchmarks over S2\mathbb{S}^2, SO(3)\mathrm{SO}(3), SPD(3)\mathrm{SPD}(3), SE(3)\mathrm{SE}(3), and H2\mathbb{H}^2, scales favorably relative to discrete manifold Sinkhorn, and in a protein-ligand docking application, refines poses on SE(3)\mathrm{SE}(3) without retraining or per-instance optimization.
Alessandro Micheli, Silvia Sapora, Anthea Monod +1
May 5, 2026math.OC

Globally Solving Unbalanced Optimal Transport and Density Control for Gaussian Distributions

In this article, we study unbalanced optimal transport (UOT) and establish a control-theoretic dynamical extension, which we call the unbalanced density control (UDC), for a class of Gaussian reference measures. In the static setting, we consider UOT with quadratic transport cost and Kullback--Leibler penalties on the marginals relative to prescribed Gaussian measures. We show that the infinite-dimensional variational problem admits an exact Gaussian reduction, yielding a finite-dimensional optimization over masses, means, and covariances, together with a closed-form expression for the optimal transported mass. We then formulate UDC for discrete-time linear systems, where the initial and terminal state measures are imposed softly through KL penalties and the intermediate evolution is governed by controlled linear dynamics with quadratic control cost. For this problem, we prove that any feasible solution can be replaced, without loss of optimality, by a Gaussian initial measure and an affine-Gaussian control policy. This leads to an exact finite-dimensional reformulation and, after a standard covariance-steering lifting, to an SDP-based optimization for fixed mass, again coupled with a closed-form mass update. We further establish existence of optimal solutions and identify a sufficient condition under which the affine-Gaussian UDC policy is deterministic. These results provide globally optimal solution methods for both Gaussian UOT and Gaussian UDC. Finally, we illustrate our results with several numerical examples.
Haruto Nakashima, Siddhartha Ganguly, Kenji Kashima
May 5, 2026cs.LG

A Provably Convergent and Practical Algorithm for Gromov--Wasserstein Optimal Transport

Gromov--Wasserstein optimal transport (GWOT) aligns metric measure spaces by matching their within-domain relational structures, but large-scale GWOT remains challenging because its objective is nonconvex and projection onto the transport polytope is often solved only approximately in practice. This leads to a gap between practical projected-gradient implementations and convergence theory, which typically assumes exact projections. For squared-loss GWOT, we propose an inexact projected-gradient framework with a verifiable feasibility-residual-based inexact condition for the projection subproblem. This condition is directly computable and avoids unknown quantities such as the exact projection point. Under this implementable condition, we prove subsequential convergence to stationary points and, with a mild tolerance-decay condition, convergence of the whole sequence. The resulting method retains the simplicity and sparsity of projected-gradient schemes while providing rigorous convergence guarantees, turning projected-gradient methods into a principled and scalable approach for GWOT with provable reliability.
Ling Liang, Lei Yang
May 4, 2026cs.RO

Sampling-Based Control via Entropy-Regularized Optimal Transport

Sampling-based model predictive control methods like MPPI and CEM are essential for real-time control of nonlinear robotic systems, particularly where discontinuous dynamics preclude gradient-based optimization. However, these methods derive from information-theoretic objectives that are agnostic to the geometry of the control problem, leading to pathological behaviors such as mode-averaging when the cost landscape is complex. We present OT-MPC, a sampling-based algorithm that overcomes these limitations through an entropy-regularized optimal transport formulation. By computing an optimal coupling between candidate control sequences and low-cost proposals, OT-MPC refines candidates toward nearby promising samples while coordinating updates across the ensemble to maintain coverage of the solution space. We derive closed-form, gradient-free updates via the Sinkhorn algorithm, enabling real-time performance. Experiments on navigation, manipulation, and locomotion tasks demonstrate improved success rates over existing methods.
Vincent Pacelli, Akash Ratheesh, Evangelos A. Theodorou
May 3, 2026cs.LG

Training Non-Differentiable Networks via Optimal Transport

Hard thresholds, quantization, and discrete routing can produce training losses with flat regions and jumps, where ordinary gradients vanish or are undefined. We introduce PolyStep, a forward-only optimizer that evaluates rotated polytope probes and moves parameter blocks along weighted averages of the probe directions. We derive the weights from one-sided entropic transport and use its uncoupled softmax solution in our primary experiments. Our analysis explains when variation among probe costs produces motion and when that motion decreases the loss. On a regular simplex, nonconstant costs always give a nonzero direction. For monotone ridge losses, the softmax update cannot increase the loss at any positive temperature; a perturbation bound gives sufficient conditions for descent near curved jumps. For bounded measurable losses, we randomize the probe radii and identify an exact smoothing whose gradient equals the expected linear cost-weighted direction up to scale. This identity yields a stationarity bound for an idealized fixed-temperature variant: under regularity and sampling assumptions stronger than those met by our trained configurations, the bound has an O(T1/2)O(T^{-1/2}) term and a persistent bias floor. We evaluate the practical method on networks with hard operations, discrete optimization, and policy search. On MNIST with hard-threshold spiking neurons, PolyStep reaches 93.0±0.2%93.0 \pm 0.2\%, compared with 79.6±5.2%79.6 \pm 5.2\% for the best-tuned gradient-free baseline at matched evaluations. These gains come with a query cost proportional to the search dimension per fresh step, which limits the number of updates available at a fixed budget.
An T. Le
May 3, 2026cs.LG

Analytic Bridge Diffusions for Controlled Path Generation

Most modern bridge-diffusion methods achieve finite-time transport by specifying an interpolation, Schrödinger-bridge, or stochastic-control objective and then learning the associated score or drift field with a neural network. In contrast, we identify a restricted but sufficiently broad and analytically solvable class in which the score, intermediate marginals, and protocol gradients are available in closed form without inner stochastic simulation loops and without neural networks in the optimization loop. We recast the classical linear--quadratic--Gaussian (LQG) stochastic-control structure as a transport problem of the Path Integral Diffusion (PID) type. In classical LQG control, linear dynamics, Gaussian noise, and quadratic costs lead to Riccati equations and closed-form optimal feedback. In LQ-GM-PID, we retain the linear--quadratic stochastic-control backbone, but replace terminal state regulation by a prescribed terminal probability density and allow both the initial and terminal laws to be Gaussian Mixtures (GM). Moreover, LQ-GM-PID turns bridge diffusion from a tool for terminal target matching alone into a tool for path shaping. We demonstrate this on a 2D corridor task, a 2D multi-entrance transport task, and a high-dimensional scaling study with d=32d=32 and M=16M=16 Gaussian-mixture terminal modes, all with sub-50,ms analytic precompute on a laptop. We position LQ-GM-PID as an analytically solvable reference model for the state-of-the-art neural bridge-diffusion and generative-transport methods: a controlled setting in which neural approximations, score estimates, path-shaping objectives, and protocol-learning procedures can be tested against exact quantities.
Michael Chertkov
May 2, 2026hep-ex

Data-Driven, Geometry-Aware Optimal-Transport Calibration of Flavor Tagger

Flavor-tagging calibrations are often provided either as scale factors measured at a finite set of working points or as binned corrections to a chosen one-dimensional discriminant. However, this approach falls short of providing continuous, event-level calibration across the full multicomponent outputs of modern taggers. This limitation leads to information loss in analyses that demand high-performance flavor tagging, restricting analyses to a limited set of predefined variables. In this work, we propose a geometry-aware framework that formulates flavor-tagger calibration as an optimal transport problem on the probability simplex. The transport maps are parameterized and trained in the isometric log-ratio coordinate system. Because the quadratic Euclidean cost of Brenier transport in this coordinate system is equivalent to the Aitchison distance on the simplex, the learned map induces a minimal deformation under the Aitchison geometry. Furthermore, we extract flavor-conditional target distributions directly from control-region data using an expectation-maximization (EM) technique that simultaneously fits multiple control regions, models each flavor component with a normalizing flow, and estimates the regional mixture fractions. The extracted targets are subsequently used to learn flavor-factorized transport maps. Because the joint estimation of mixture fractions and flexible component densities admits weakly constrained directions, we further introduce a linearized feedback-operator analysis that propagates the fitted composition covariance into the extracted component densities, separating data-constrained modes from those dominated by the composition prior. The simulation-based closure study demonstrates improved closure in dedicated control regions and in independent validation mixtures.
Yeonjoon Kim, Un-ki Yang
May 1, 2026cs.LG

Beyond Continuity: Simulation-free Reconstruction of Discrete Branching Dynamics from Single-cell Snapshots

Inferring cellular trajectories from destructive snapshots is complicated by the challenges of stochasticity and non-conservative mass dynamics such as cell proliferation and apoptosis. Existing unbalanced Optimal Transport (OT) methods treat mass as a continuous fluid, performing inference at the population level. However, this macroscopic view often fails to capture the discrete, jump-like nature of birth-death events at single-cell resolution, which is essential for understanding lineage branching and fate decisions. We present Unbalanced Schrödinger Bridge (USB), a simulation-free framework for learning underlying dynamics that effectively integrates both stochastic and unbalanced effects which also models the discrete, jump-like birth-death dynamics at single-cell resolution. Theoretically, USB provides a tractable solution to the Branching Schrödinger Bridge (BSB) problem, offering a rigorous microscopic interpretation where individual cells undergo both Brownian motion and discrete birth-death jumps. Technically, the method implements an efficient solver by introducing a simulation-free training objective that effectively scales to high-dimensional omics data. Empirically, we demonstrate on both simulated and real-world datasets that USB not only achieves trajectory reconstruction performance better than or comparable to deterministic baselines but also uniquely enables realistic discrete simulation of birth-death dynamics at single-cell resolution.
Junda Ying, Yuxuan Wang, Bowen Yang +2
Apr 29, 2026cs.LG

Hyper Input Convex Neural Networks for Shape Constrained Learning and Optimal Transport

We introduce Hyper Input Convex Neural Networks (HyCNNs), a novel neural network architecture designed for learning convex functions. HyCNNs combine the principles of Maxout networks with input convex neural networks (ICNNs) to create a neural network that is always convex in the input, theoretically capable of leveraging depth, and performs reliable when trained at scale compared to ICNNs. Concretely, we prove that HyCNNs require exponentially fewer parameters than ICNNs to approximate quadratic functions up to a given precision. Throughout a series of synthetic experiments, we demonstrate that HyCNNs outperform existing ICNNs and MLPs in terms of predictive performance for convex regression and interpolation tasks. We further apply HyCNNs to learn high-dimensional optimal transport maps for synthetic examples and for single-cell RNA sequencing data, where they oftentimes outperform ICNN-based neural optimal transport methods and other baselines across a wide range of settings.
Shayan Hundrieser, Insung Kong, Johannes Schmidt-Hieber
Apr 28, 2026cs.LG

Block-Wise Differentiable Sinkhorn Attention: Tail-Refinement Gradients with a Gap-Aware Dustbin Bridge

We study long-context balanced entropic optimal transport (OT) attention on TPU hardware through a stopped-base, fixed-depth tail-refinement surrogate. After a stopped TT-step Sinkhorn solve, we unroll a short refinement tail and differentiate that surrogate exactly. For the reported R=2R=2 TPU path, the backward pass contains four staircase plan factors. We prove an exact one-reference-tile schedule: the R=2R=2 score cotangent is a single reference plan tile times an explicit modifier field built from vector cotangents and dual differences. This yields block-wise cost O((T+R)LW)O((T+R)LW), O(Ld)O(Ld) input storage, and O(L)O(L) additional HBM usage for fixed head dimension dd and band width WW on the balanced fixed-support path. We also formalize the current \texttt{dustbin_block} path as the same unit-target surrogate on an augmented support, so the adjoint schedule lifts to the single-active-dustbin path used in our TPU runs; this bridge is algebraic and does not claim a general KL-unbalanced or arbitrary-capacity gap model. We provide a local surrogate-bias bound, an a posteriori bias certificate, and a projective contraction certificate for strictly positive active blocks. On synthetic masked problems, the optimized kernel matches exact autodiff of the same centered surrogate to within 10510^{-5}--101010^{-10}. On TPU v6e-8, a four-configuration Pfam screen completes end-to-end, and a promoted balanced R=2R=2 run sustains roughly 8.58.5 examples per second through a three-hour budget, reaching step 14371437. Held-out Pfam test shards improve reconstruction from 5.575.57 to 2.052.05 and sparse CE from 5.535.53 to 5.305.30 relative to step 00, with CE logged diagnostically rather than optimized directly; target-barycenter alignment metrics do not materially improve, and a deterministic diagonal reference remains stronger on those metrics.
Dylan Forde
Apr 27, 2026stat.ML

Sliced-Regularized Optimal Transport

We propose a new regularized optimal transport (OT) formulation, termed sliced-regularized optimal transport (SROT). Unlike entropic OT (EOT), which regularizes the transport plan toward an independent coupling, SROT regularizes it toward a smoothened sliced OT (SOT) plan. To the best of our knowledge, SROT is the first approach to leverage a version of SOT plan as a reference to improve classical OT. We provide a formal definition of SROT, derive its dual formulation, and provide a post-Bayesian interpretation of SROT. We then develop a Sinkhorn-style algorithm for efficient computation, retaining the same scalability advantages as EOT. By incorporating a scalable SOT plan as a prior, SROT yields more accurate approximations of the exact OT plan than EOT under the same level of regularization. Moreover, the resulting transport plan improves upon the reference SOT plan itself. We further introduce the corresponding OT divergence induced by SROT, named SROT divergence, and analyze its topological and computational properties. Finally, we validate our approach through experiments on synthetic datasets and color transfer tasks, demonstrating that SROT is better than both EOT and SOT in approximating exact OT. Additional experiments on gradient flows further highlight the advantages of SROT divergence.
Khai Nguyen
Apr 23, 2026stat.ML

Beyond Expected Information Gain: Stable Bayesian Optimal Experimental Design with Integral Probability Metrics and Plug-and-Play Extensions

Bayesian Optimal Experimental Design (BOED) provides a rigorous framework for decision-making tasks in which data acquisition is often the critical bottleneck, especially in resource-constrained settings. Traditionally, BOED typically selects designs by maximizing expected information gain (EIG), commonly defined through the Kullback-Leibler (KL) divergence. However, classical evaluation of EIG often involves challenging nested expectations, and even advanced variational methods leave the underlying log-density-ratio objective unchanged. As a result, support mismatch, tail underestimation, and rare-event sensitivity remain intrinsic concerns for KL-based BOED. To address these fundamental bottlenecks, we introduce an IPM-based BOED framework that replaces density-based divergences with integral probability metrics (IPMs), including the Wasserstein distance, Maximum Mean Discrepancy, and Energy Distance, resulting in a highly flexible plug-and-play BOED framework. We establish theoretical guarantees showing that IPM-based utilities provide stronger geometry-aware stability under surrogate-model error and prior misspecification than classical EIG-based utilities. We also validate the proposed framework empirically, demonstrating that IPM-based designs yield highly concentrated credible sets. Furthermore, by extending the same sample-based BOED template in a plug-and-play manner to geometry-aware discrepancies beyond the IPM class, illustrated by a neural optimal transport estimator, we achieve accurate optimal designs in high-dimensional settings where conventional nested Monte Carlo estimators and advanced variational methods fail.
Di Wu, Ling Liang, Haizhao Yang
Apr 23, 2026cs.CV

Deep kernel video approximation for unsupervised action segmentation

This work focuses on per-video unsupervised action segmentation, which is of interest to applications where storing large datasets is either not possible, or nor permitted. We propose to segment videos by learning in deep kernel space, to approximate the underlying frame distribution, as closely as possible. To define this closeness metric between the original video distribution and its approximation, we rely on maximum mean discrepancy (MMD) which is a geometry-preserving metric in distribution space, and thus gives more reliable estimates. Moreover, unlike the commonly used optimal transport metric, MMD is both easier to optimize, and faster. We choose to use neural tangent kernels (NTKs) to define the kernel space where MMD operates, because of their improved descriptive power as opposed to fixed kernels. And, also, because NTKs sidestep the trivial solution, when jointly learning the inputs (video approximation) and the kernel function. Finally, we show competitive results when compared to state-of-the-art per-video methods, on six standard benchmarks. Additionally, our method has higher F1 scores than prior agglomerative work, when the number of segments is unknown.
Silvia L. Pintea, Jouke Dijkstra
Apr 22, 2026cs.LG

On the Role of Strain and Vorticity in Numerical Integration Error for Flow Matching

Flow matching generates data by integrating a learned velocity field, where the number of integration steps (NFE) directly determines inference cost. We analyze which properties of the velocity field govern integration error by decomposing the velocity Jacobian into its symmetric part S (strain rate) and antisymmetric part Omega (vorticity). We prove that strain and vorticity play different roles: strain controls exponential error amplification through the logarithmic norm, while vorticity contributes only linearly to the local truncation error. We further show that the optimal transport velocity field is irrotational and has zero material derivative, implying second-order Euler accuracy; for exact displacement interpolation, the associated Lagrangian particle dynamics are integrated exactly by Euler. Motivated by this analysis, we study weighted Jacobian regularization with strain weight alpha and vorticity weight beta. Experiments on 2D synthetic data confirm the main theoretical predictions, showing up to 2.7x lower integration error at NFE=5. Preliminary CIFAR-10 experiments show consistent trends, with a lightweight fine-tuning procedure improving FID by 14 percent at NFE=10 while preserving high-NFE quality.
Chenxi Tao, Seung-Kyum Choi
Apr 22, 2026stat.ML

Learning to Emulate Chaos: Adversarial Optimal Transport Regularization

Chaos arises in many complex dynamical systems, from weather to power grids, but is difficult to accurately model with data-driven methods such as machine learning emulators. While emulators are promising tools for accelerating simulations and solving inverse problems, they still struggle to learn chaotic dynamics, where sensitivity to initial conditions renders exact long-term forecasts infeasible, especially given noisy data. Recent work instead trains emulators to match the statistical properties of chaotic attractors, but these approaches often rely on handcrafted summary statistics or large, diverse multi-environment datasets. In this work, we propose a family of adversarial optimal transport objectives that can jointly learn high-quality summary statistics and a physically consistent emulator from a single noisy trajectory. We theoretically analyze and experimentally validate a Sinkhorn divergence formulation (2-Wasserstein) and a WGAN-style dual formulation (1-Wasserstein) of our approach. Numerical experiments across a variety of chaotic systems, including ones with high-dimensional spatiotemporal chaos, show that emulators trained using our proposed objectives have significantly improved long-term statistical fidelity.
Gabriel Melo, Leonardo Santiago, Peter Y. Lu
Apr 20, 2026eess.IV

Optimally Bridging Semantics and Data: Generative Semantic Communication via Schrödinger Bridge

Generative Semantic Communication (GSC) is a promising solution for image transmission over narrow-band and high-noise channels. However, existing GSC methods rely on long, indirect transport trajectories from a Gaussian to an image distribution guided by semantics, causing severe hallucination and high computational cost. To address this, we propose a general framework named Schrödinger Bridge-based GSC (SBGSC). By leveraging the Schrödinger Bridge (SB) to construct optimal transport trajectories between arbitrary distributions, SBGSC breaks Gaussian limitations and enables direct generative decoding from semantics to images. Within this framework, we design Diffusion SB-based GSC (DSBGSC). DSBGSC reconstructs the nonlinear drift term of diffusion models using Schrödinger potentials, achieving direct optimal distribution transport to reduce hallucinations and computational overhead. To further accelerate generation, we propose a self-consistency-based objective guiding the model to learn a nonlinear velocity field pointing directly toward the image, bypassing Markovian noise prediction to significantly reduce sampling steps. Simulation results demonstrate that DSBGSC outperforms state-of-the-art GSC methods, improving FID by at least 38% and SSIM by 49.3%, while accelerating inference speed by over 8 times.
Dahua Gao, Ruichao Liu, Minxi Yang +3
Apr 17, 2026cs.LG

OT on the Map: Quantifying Domain Shifts in Geographic Space

In computer vision and machine learning for geographic data, out-of-domain generalization is a pervasive challenge, arising from uneven global data coverage and distribution shifts across geographic regions. Though models are frequently trained in one region and deployed in another, there is no principled method for determining when this cross-region adaptation will be successful. A well-defined notion of distance between distributions can effectively quantify how different a new target domain is compared to the domains used for model training, which in turn could support model training and deployment decisions. In this paper, we propose a strategy for computing distances between geospatial domains that leverages geographic information with Optimal Transport methods (GeoSpOT). In our experiments, GeoSpOT distances emerge as effective predictors of cross-domain transfer difficulty. We further demonstrate that embeddings from pretrained location encoders provide information comparable to image/text embeddings, despite relying solely on longitude-latitude pairs as input. This allows users to get an approximation of out-of-domain performance for geospatial models, even when the exact downstream task is unknown, or no task-specific data is available. Building on these findings, we show that GeoSpOT distances can preemptively guide data selection and enable predictive tools to analyze regions where a model is likely to underperform.
Haoran Zhang, Livia Betti, Konstantin Klemmer +2
Apr 16, 2026stat.ML

Amortized Optimal Transport from Sliced Potentials

We propose a novel amortized optimization method for predicting optimal transport (OT) plans across multiple pairs of measures by leveraging Kantorovich potentials derived from sliced OT. We introduce two amortization strategies: regression-based amortization (RA-OT) and objective-based amortization (OA-OT). In RA-OT, we formulate a functional regression model that treats Kantorovich potentials from the original OT problem as responses and those obtained from sliced OT as predictors, and estimate these models via least-squares methods. In OA-OT, we estimate the parameters of the functional model by optimizing the Kantorovich dual objective. In both approaches, the predicted OT plan is subsequently recovered from the estimated potentials. As amortized OT methods, both RA-OT and OA-OT enable efficient solutions to repeated OT problems across different measure pairs by reusing information learned from prior instances to rapidly approximate new solutions. Moreover, by exploiting the structure provided by sliced OT, the proposed models are more parsimonious, independent of specific structures of the measures, such as the number of atoms in the discrete case, while achieving high accuracy. We demonstrate the effectiveness of our approaches on tasks including MNIST digit transport, color transfer, supply-demand transportation on spherical data, and mini-batch OT conditional flow matching.
Minh-Phuc Truong, Khai Nguyen
Apr 16, 2026eess.SP

Enhancing time-frequency resolution with optimal transport and barycentric fusion of multiple spectrogram

Time-frequency representations, such as the short-time Fourier transform (STFT), are fundamental tools for analyzing non-stationary signals. However, their ability to achieve sharp localization in both time and frequency is inherently limited by the Gabor-Heisenberg uncertainty principle. In this paper, we address this limitation by introducing a method to generate super-resolution spectrograms through the fusion of two or more spectrograms with varying resolutions. Specifically, we compute the super-resolution spectrogram as the barycenter of input spectrograms using optimal transport (OT) divergences. Unlike existing fusion approaches, our method does not require the input spectrograms to share the same time-frequency grid. Instead, the input spectrograms can be computed using any STFT parameters, and the resulting super-resolution spectrogram can be defined on an arbitrary user-specified grid. We explore various OT divergences based on different transportation costs. Notably, we introduce a novel transportation cost that preserves time-frequency geometry while significantly reducing computational complexity compared to standard Wasserstein barycenters. We adopt the unbalanced OT framework and derive a new block majorization-minimization algorithm for efficient barycenter computation. We validate the proposed method on controlled synthetic signals and recorded speech using both quantitative and qualitative evaluations. The results show that our approach combines the best localization properties of the input spectrograms and outperforms an unsupervised state-of-the-art fusion method.
David Valdivia, Elsa Cazelles, Cédric Févotte
Apr 16, 2026cs.LG

Wasserstein Formulation of Reinforcement Learning. An Optimal Transport Perspective on Policy Optimization

We present a geometric framework for Reinforcement Learning (RL) that views policies as maps into the Wasserstein space of action probabilities. First, we define a Riemannian structure induced by stationary distributions, proving its existence in a general context. We then define the tangent space of policies and characterize the geodesics, specifically addressing the measurability of vector fields mapped from the state space to the tangent space of probability measures over the action space. Next, we formulate a general RL optimization problem and construct a gradient flow using Otto's calculus. We compute the gradient and the Hessian of the energy, providing a formal second-order analysis. Finally, we illustrate the method with numerical examples for low-dimensional problems, computing the gradient directly from our theoretical formalism. For high-dimensional problems, we parameterize the policy using a neural network and optimize it based on an ergodic approximation of the cost.
Mathias Dus
Mar 28, 2026math.OC

Adjoint Matching through the Lens of the Stochastic Maximum Principle in Optimal Control

Reward fine-tuning of diffusion and flow models and sampling from tilted or Boltzmann distributions can both be formulated as stochastic optimal control (SOC) problems, where learning an optimal generative dynamics corresponds to optimizing a control under SDE constraints. In this work, we revisit and generalize Adjoint Matching, a recently proposed SOC-based method for learning optimal controls, and place it on a rigorous footing by deriving it from the Stochastic Maximum Principle (SMP). We formulate a general Hamiltonian adjoint matching objective for SOC problems with control-dependent drift and diffusion and convex running costs, and show that its expected value has the same first variation as the original SOC objective. As a consequence, critical points satisfy the Hamilton--Jacobi--Bellman (HJB) stationarity conditions. In the important practical case of state- and control-independent diffusion, we recover the lean adjoint matching loss previously introduced, which avoids second-order terms and whose critical points coincide with the optimal control under mild uniqueness assumptions. Numerical experiments confirm that the extra terms it discards become necessary once the diffusion is state-dependent. Finally, we show that adjoint matching can be precisely interpreted as a continuous-time method of successive approximations induced by the SMP, yielding a practical and implementable alternative to classical SMP-based algorithms, which are obstructed by intractable martingale terms in the stochastic setting. These results are also of independent interest to the stochastic control community, providing new implementable objectives and a viable pathway for SMP-based iterations in stochastic problems.
Carles Domingo-Enrich, Jiequn Han
Mar 11, 2026stat.ML

Trustworthy Predictive Distributions for Tail Events with Semiparametric Diagnostic Transport Maps

Machine learning forecast systems are moving beyond point predictions to full predictive distributions for future outcomes y conditional on complex inputs x. However, these distributions are often locally miscalibrated, especially for high-stakes tail events where accurate uncertainty quantification is most needed to establish trust in models. Local miscalibration occurs because training data often lack examples of low-frequency events. The goal of this paper is to describe a simple, yet flexible framework that, at deployment, produces interpretable diagnostics and a robust correction mechanism of predictive distributions when train examples are limited. With this goal in mind, we introduce a semiparametric version of the Local Amortized Diagnostic and Reshaping (LADaR) framework that posits a covariate-dependent parametric model for a diagnostic transport map regressed nonparametrically on inputs to describe how to correct tail probabilities across the feature space to match calibration data. These maps provide the user with local, real-time diagnostics and a reshaped predictive distribution that can be related back to physical processes in the input space. We apply these semiparametric diagnostic transport maps to short-term tropical cyclone intensity forecasting to detect evolutionary modes linked to local miscalibration in the National Hurricane Center's forecasts and improve predictions for severe weather hazards.
Elizabeth Cucuzzella, Rafael Izbicki, Ann B. Lee
Feb 26, 2026cs.LG

SOTAlign: Semi-Supervised Alignment of Unimodal Vision and Language Models via Optimal Transport

The Platonic Representation Hypothesis posits that neural networks trained on different modalities converge toward a shared statistical model of the world. Recent work exploits this convergence by aligning frozen pretrained vision and language models with lightweight alignment layers, but typically relies on contrastive losses and millions of paired samples. In this work, we ask whether meaningful alignment can be achieved with substantially less supervision. We introduce a semi-supervised setting in which pretrained unimodal encoders are aligned using a small number of image-text pairs together with large amounts of unpaired data. To address this challenge, we propose SOTAlign, a two-stage framework that first recovers a coarse shared geometry from limited paired data using a linear teacher, and then refines the alignment on unpaired samples via an optimal-transport-based divergence that transfers relational structure without overconstraining the target space. SOTAlign effectively leverages unpaired images and text, learning robust joint embeddings across datasets and encoder pairs, and significantly outperforming supervised and semi-supervised baselines. Code is available at https://github.com/ExplainableML/SOTAlign.
Simon Roschmann, Paul Krzakala, Sonia Mazelet +2
Feb 23, 2026stat.ML

Manifold-Aligned Generative Transport

Many high-dimensional datasets concentrate near a low-dimensional structure embedded in the ambient space. Generative models for such data must control off-support mass while remaining computationally practical. Diffusion models use iterative denoising at inference, whereas standard normalizing flows require invertible, dimension-preserving maps. We propose MAGT (Manifold-Aligned Generative Transport), a direct transport from a low-dimensional base distribution to the data space. Its core objective compares the data and generator-induced scores at a selected Gaussian smoothing level. A posterior identity expresses this score through a latent conditional mean, which is approximated by self-normalized importance sampling over a finite anchor set. After training, generation requires one evaluation of the transport, whose image also carries an intrinsic density with respect to manifold volume. We establish a minimax-optimal Wasserstein convergence rate for an explicitly constructed localized spline-RePU coordinate transport estimator, and treat finite-anchor approximation separately. Experiments on synthetic, image, and tabular benchmarks compare fidelity, support alignment, and sampling cost with diffusion, flow-matching, and adversarial baselines.
Xinyu Tian, Xiaotong Shen
Feb 11, 2026stat.ML

Convergence Rates for Distribution Matching with Sliced Optimal Transport

We study the slice-matching scheme, an efficient iterative method for distribution matching based on sliced optimal transport. We investigate convergence to the target distribution and derive quantitative non-asymptotic rates. To this end, we establish Lojasiewicz-type inequalities for the Sliced-Wasserstein objective. A key challenge is to control along the trajectory the constants in these inequalities. We show that this becomes tractable for Gaussian distributions. Specifically, eigenvalues are controlled when matching along random orthonormal bases at each iteration. We complement our theory with numerical experiments and illustrate the predicted dependence on dimension and step-size, as well as the stabilizing effect of orthonormal-basis sampling.
Gauthier Thurin, Claire Boyer, Kimia Nadjahi
Feb 2, 2026cs.CV

PISCES: Annotation-free Text-to-Video Post-Training via Optimal Transport-Aligned Rewards

Text-to-video (T2V) generation aims to synthesize videos with high visual quality and temporal consistency that are semantically aligned with input text. Reward-based post-training has emerged as a promising direction to improve the quality and semantic alignment of generated videos. However, recent methods either rely on large-scale human preference annotations or operate on misaligned embeddings from pre-trained vision-language models, leading to limited scalability or suboptimal supervision. We present PISCES\texttt{PISCES}, an annotation-free post-training algorithm that addresses these limitations via a novel Dual Optimal Transport (OT)-aligned Rewards module. To align reward signals with human judgment, PISCES\texttt{PISCES} uses OT to bridge text and video embeddings at both distributional and discrete token levels, enabling reward supervision to fulfill two objectives: (i) a Distributional OT-aligned Quality Reward that captures overall visual quality and temporal coherence; and (ii) a Discrete Token-level OT-aligned Semantic Reward that enforces semantic, spatio-temporal correspondence between text and video tokens. To our knowledge, PISCES\texttt{PISCES} is the first to improve annotation-free reward supervision in generative post-training through the lens of OT. Experiments on both short- and long-video generation show that PISCES\texttt{PISCES} outperforms both annotation-based and annotation-free methods on VBench across Quality and Semantic scores, with human preference studies further validating its effectiveness. We show that the Dual OT-aligned Rewards module is compatible with multiple optimization paradigms, including direct backpropagation and reinforcement learning fine-tuning. Project page: https://roar-ai.github.io/pisces
Minh-Quan Le, Gaurav Mittal, Cheng Zhao +3
Sep 30, 2025cs.LG

Data-to-Energy Stochastic Dynamics

The Schrödinger bridge problem is concerned with finding a stochastic dynamical system bridging two marginal distributions that minimises a certain transportation cost. This problem, which represents a generalisation of optimal transport to the stochastic case, has received attention due to its connections to diffusion models and flow matching, as well as its applications in the natural sciences. However, all existing algorithms allow to infer such dynamics only for cases where samples from both distributions are available. In this paper, we propose the first general method for modelling Schrödinger bridges when one (or both) distributions are given by their unnormalised densities, with no access to data samples. Our algorithm relies on a generalisation of the iterative proportional fitting (IPF) procedure to the data-free case, inspired by recent developments in off-policy reinforcement learning for training of diffusion samplers. We demonstrate the efficacy of the proposed data-to-energy IPF on synthetic problems, finding that it can successfully learn transports between multimodal distributions. As a secondary consequence of our reinforcement learning formulation, which assumes a fixed time discretisation scheme for the dynamics, we find that existing data-to-data Schrödinger bridge algorithms can be substantially improved by learning the diffusion coefficient of the dynamics. Finally, we apply the newly developed algorithm to the problem of sampling posterior distributions in latent spaces of generative models, thus creating a data-free image-to-image translation method. Code: https://github.com/mmacosha/d2e-stochastic-dynamics
Kirill Tamogashev, Esmeralda S. Whitammer