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Machine learning potentials (MLPs) are becoming powerful tools for performing accurate atomistic simulations and crystal structure optimizations. An approach to developing MLPs employs a systematic set of polynomial invariants including…

Computational Physics · Physics 2020-11-18 Atsuto Seko

This paper provides a review of model selection and model averaging methods for multinomial probit models estimated using the MACML approach. The proposed approaches are partitioned into test based methods (mostly derived from the…

Methodology · Statistics 2017-04-04 Manuel Batram , Dietmar Bauer

Optimizing the assortment of products to display to customers is a key to increasing revenue for both offline and online retailers. To trade-off between exploring customers' preference and exploiting customers' choices learned from data, in…

Machine Learning · Computer Science 2022-04-25 Hongbin Zhang , Yu Yang , Feng Wu , Qixin Zhang

Reinforcement learning with multinomial logistic (MNL) function approximation has become an important framework due to its flexibility and broad applicability. While existing studies have established regret guarantees under worst-case…

Machine Learning · Statistics 2026-05-28 Wonyoung Kim , Min-Hwan Oh , Garud Iyengar , Assaf Zeevi

The Predict-Then-Optimize framework uses machine learning models to predict unknown parameters of an optimization problem from exogenous features before solving. This setting is common to many real-world decision processes, and recently it…

Machine Learning · Computer Science 2024-09-10 James Kotary , Vincenzo Di Vito , Jacob Cristopher , Pascal Van Hentenryck , Ferdinando Fioretto

We study the problem of learning a partially observed matrix under the low rank assumption in the presence of fully observed side information that depends linearly on the true underlying matrix. This problem consists of an important…

Machine Learning · Statistics 2026-02-05 Dimitris Bertsimas , Nicholas A. G. Johnson

The ability to learn polynomials and generalize out-of-distribution is essential for simulation metamodels in many disciplines of engineering, where the time step updates are described by polynomials. While feed forward neural networks can…

Machine Learning · Computer Science 2023-07-21 Jesper Hauch , Christoffer Riis , Francisco C. Pereira

The mixed multinomial logit model assumes constant preference parameters of a decision-maker throughout different choice situations, which may be considered too strong for certain choice modelling applications. This paper proposes an…

Machine Learning · Statistics 2023-03-30 Mirosława Łukawska , Anders Fjendbo Jensen , Filipe Rodrigues

In ordinal classification, misclassifying neighboring ranks is common, yet the consequences of these errors are not the same. For example, misclassifying benign tumor categories is less consequential, compared to an error at the…

Computer Vision and Pattern Recognition · Computer Science 2026-01-13 Dileepa Pitawela , Gustavo Carneiro , Hsiang-Ting Chen

Conjoint experiments randomize multidimensional profiles, offering a powerful design for recovering structural preference parameters -- including marginal rates of substitution, willingness to pay, and the distribution of preferences across…

Methodology · Statistics 2026-05-26 Avidit Acharya , Jens Hainmueller , Yiqing Xu

This paper introduces a new data-driven methodology for nested logit structure discovery. Nested logit models allow the modeling of positive correlations between the error terms of the utility specifications of the different alternatives in…

Methodology · Statistics 2020-08-19 Youssef M. Aboutaleb , Moshe Ben-Akiva , Patrick Jaillet

Large language models (LLMs) alignment aims to ensure that the behavior of LLMs meets human preferences. While collecting data from multiple fine-grained, aspect-specific preferences becomes more and more feasible, existing alignment…

Machine Learning · Computer Science 2026-03-03 Jia Zhang , Yao Liu , Chen-Xi Zhang , Yi Liu , Yi-Xuan Jin , Lan-Zhe Guo , Yu-Feng Li

We introduce a new model of membership query (MQ) learning, where the learning algorithm is restricted to query points that are \emph{close} to random examples drawn from the underlying distribution. The learning model is intermediate…

Machine Learning · Computer Science 2013-04-19 Pranjal Awasthi , Vitaly Feldman , Varun Kanade

Can large language models (LLMs) learn a decision maker's preferences from observed choices and generate preference-consistent recommendations in new situations? We propose a portable Simulate-Recommend-Evaluate framework that tests…

General Economics · Economics 2026-04-08 Jeongbin Kim , Matthew Kovach , Kyu-Min Lee , Euncheol Shin , Hector Tzavellas

Inspired by coarse-graining approaches used in physics, we show how similar algorithms can be adapted for data. The resulting algorithms are based on layered tree tensor networks and scale linearly with both the dimension of the input and…

Machine Learning · Statistics 2018-05-01 E. M. Stoudenmire

Motivated by e-commerce, we study the online assortment optimization problem. The seller offers an assortment, i.e. a subset of products, to each arriving customer, who then purchases one or no product from her offered assortment. A…

Machine Learning · Computer Science 2017-04-04 Wang Chi Cheung , David Simchi-Levi

The existing work on the distributed training of machine learning (ML) models has consistently overlooked the distribution of the achieved learning quality, focusing instead on its average value. This leads to a poor dependability}of the…

Machine Learning · Computer Science 2024-02-23 Francesco Malandrino , Giuseppe Di Giacomo , Marco Levorato , Carla Fabiana Chiasserini

In the absence of prior knowledge, ordinal embedding methods obtain new representation for items in a low-dimensional Euclidean space via a set of quadruple-wise comparisons. These ordinal comparisons often come from human annotators, and…

Machine Learning · Computer Science 2018-12-06 Ke Ma , Qianqian Xu , Zhiyong Yang , Xiaochun Cao

We consider the problem of learning a mixture of linear regressions (MLRs). An MLR is specified by $k$ nonnegative mixing weights $p_1, \ldots, p_k$ summing to $1$, and $k$ unknown regressors $w_1,...,w_k\in\mathbb{R}^d$. A sample from the…

Data Structures and Algorithms · Computer Science 2019-12-18 Sitan Chen , Jerry Li , Zhao Song

We introduce Mixture-based Feature Space Learning (MixtFSL) for obtaining a rich and robust feature representation in the context of few-shot image classification. Previous works have proposed to model each base class either with a single…

Computer Vision and Pattern Recognition · Computer Science 2021-08-18 Arman Afrasiyabi , Jean-François Lalonde , Christian Gagné