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We disprove a conjecture in Density Functional Theory, relative to multimarginal optimal transport maps with Coulomb cost. We also provide examples of maps satisfying optimality conditions for special classes of data.

Analysis of PDEs · Mathematics 2015-07-31 Maria Colombo , Federico Stra

It is evidence that representation learning can improve model's performance over multiple downstream tasks in many real-world scenarios, such as image classification and recommender systems. Existing learning approaches rely on establishing…

Machine Learning · Computer Science 2022-02-18 Mengyue Yang , Xinyu Cai , Furui Liu , Xu Chen , Zhitang Chen , Jianye Hao , Jun Wang

We study multi-marginal optimal transport problems from a probabilistic graphical model perspective. We point out an elegant connection between the two when the underlying cost for optimal transport allows a graph structure. In particular,…

Optimization and Control · Mathematics 2020-06-26 Isabel Haasler , Rahul Singh , Qinsheng Zhang , Johan Karlsson , Yongxin Chen

In the field of Explainable Artificial Intelligence (XAI), counterfactual examples explain to a user the predictions of a trained decision model by indicating the modifications to be made to the instance so as to change its associated…

Artificial Intelligence · Computer Science 2023-05-11 Thibault Laugel , Adulam Jeyasothy , Marie-Jeanne Lesot , Christophe Marsala , Marcin Detyniecki

Optimal Transport is a foundational mathematical theory that connects optimization, partial differential equations, and probability. It offers a powerful framework for comparing probability distributions and has recently become an important…

Machine Learning · Statistics 2025-05-13 Gabriel Peyré

Many causal and structural parameters in economics can be identified and estimated by computing the value of an optimization program over all distributions consistent with the model and the data. Existing tools apply when the data is…

Econometrics · Economics 2025-07-31 Andrei Voronin

We propose an exact iterative algorithm for minimization of a class of continuous cell-wise linear convex functions on a hyperplane arrangement. Our particular setup is motivated by evaluation of so-called rank estimators used in robust…

Optimization and Control · Mathematics 2020-01-01 Michal Černý , Milan Hladík , Miroslav Rada

Graph neural networks (GNNs) have various practical applications, such as drug discovery, recommendation engines, and chip design. However, GNNs lack transparency as they cannot provide understandable explanations for their predictions. To…

Machine Learning · Computer Science 2023-06-09 Samidha Verma , Burouj Armgaan , Sourav Medya , Sayan Ranu

Lewis' theory of counterfactuals is the foundation of many contemporary notions of causality. In this paper, we extend this theory in the temporal direction to enable symbolic counterfactual reasoning on infinite sequences, such as…

Logic in Computer Science · Computer Science 2023-06-16 Bernd Finkbeiner , Julian Siber

In model extraction attacks, the goal is to reveal the parameters of a black-box machine learning model by querying the model for a selected set of data points. Due to an increasing demand for explanations, this may involve counterfactual…

Optimization and Control · Mathematics 2026-03-04 Daan Otto , Jannis Kurtz , Dick den Hertog , Ilker Birbil

In this work we consider an optimal transport problem with coefficients in a normed Abelian group $G$, and extract a purely intrinsic condition on $G$ that guarantees that the optimal transport (or the corresponding minimum filling) is not…

Metric Geometry · Mathematics 2017-07-13 Mircea Petrache , Roger Züst

Regularising the primal formulation of optimal transport (OT) with a strictly convex term leads to enhanced numerical complexity and a denser transport plan. Many formulations impose a global constraint on the transport plan, for instance…

Machine Learning · Computer Science 2023-10-05 Hugues Van Assel , Titouan Vayer , Remi Flamary , Nicolas Courty

We present a new approach to Bayesian inference that entirely avoids Markov chain simulation, by constructing a map that pushes forward the prior measure to the posterior measure. Existence and uniqueness of a suitable measure-preserving…

Computation · Statistics 2012-08-31 Tarek A. El Moselhy , Youssef M. Marzouk

We predict credit applications with off-the-shelf, interchangeable black-box classifiers and we explain single predictions with counterfactual explanations. Counterfactual explanations expose the minimal changes required on the input data…

Artificial Intelligence · Computer Science 2018-11-19 Rory Mc Grath , Luca Costabello , Chan Le Van , Paul Sweeney , Farbod Kamiab , Zhao Shen , Freddy Lecue

Automated fact checking systems have been proposed that quickly provide veracity prediction at scale to mitigate the negative influence of fake news on people and on public opinion. However, most studies focus on veracity classifiers of…

Computation and Language · Computer Science 2022-06-15 Shih-Chieh Dai , Yi-Li Hsu , Aiping Xiong , Lun-Wei Ku

We present a simple proof of the entropy-power inequality using an optimal transportation argument which takes the form of a simple change of variables. The same argument yields a reverse inequality involving a conditional differential…

Information Theory · Computer Science 2017-03-07 Olivier Rioul

We consider Monge-Kantorovich optimal transport problems on $\mathbb{R}^d$, $d\ge 1$, with a convex cost function given by the cumulant generating function of a probability measure. Examples include the Wasserstein-2 transport whose cost…

Probability · Mathematics 2017-08-29 Soumik Pal

Counterfactual explanation is one branch of interpretable machine learning that produces a perturbation sample to change the model's original decision. The generated samples can act as a recommendation for end-users to achieve their desired…

Machine Learning · Computer Science 2023-03-28 Tri Dung Duong , Qian Li , Guandong Xu

In this work, we construct a novel numerical method for solving the multi-marginal optimal transport problems with Coulomb cost. This type of optimal transport problems arises in quantum physics and plays an important role in understanding…

Optimization and Control · Mathematics 2023-06-16 Yukuan Hu , Huajie Chen , Xin Liu

Advancements in mathematical programming have made it possible to efficiently tackle large-scale real-world problems that were deemed intractable just a few decades ago. However, provably optimal solutions may not be accepted due to the…

Optimization and Control · Mathematics 2023-12-22 Kevin-Martin Aigner , Marc Goerigk , Michael Hartisch , Frauke Liers , Arthur Miehlich
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