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Methodologies for training machine learning potentials (MLPs) to quantum-mechanical simulation data have recently seen tremendous progress. Experimental data has a very different character than simulated data, and most MLP training…

We present two novel applications of symmetries for mixed-integer linear programming. First we propose two variants of a new heuristic to improve the objective value of a feasible solution using symmetries. These heuristics can use either…

Optimization and Control · Mathematics 2014-08-19 Philipp M. Christophel , Menal Güzelsoy , Imre Pólik

Accurate representations of unknown and sub-grid physical processes through parameterizations (or closure) in numerical simulations with quantified uncertainty are critical for resolving the coarse-grained partial differential equations…

Machine Learning · Computer Science 2024-05-08 Yongquan Qu , Mohamed Aziz Bhouri , Pierre Gentine

A method to control results of gradient descent unsupervised learning in a deep neural network by using evolutionary algorithm is proposed. To process crossover of unsupervisedly trained models, the algorithm evaluates pointwise fitness of…

Machine Learning · Statistics 2018-03-29 Takeshi Inagaki

In this work an iterative algorithm based on unsupervised learning is presented, specifically on a Restricted Boltzmann Machine (RBM) to solve a perfect matching problem on a bipartite weighted graph. Iteratively is calculated the weights…

Optimization and Control · Mathematics 2019-05-03 Francesco Curia

This paper addresses a mixed integer programming (MIP) formulation for the multi-item uncapacitated lot-sizing problem that is inspired from the trailer manufacturer. The proposed MIP model has been utilized to find out the optimum order…

Optimization and Control · Mathematics 2012-06-01 Maryam Mohammadi , Masine Md. Tap

The optimal binning is the optimal discretization of a variable into bins given a discrete or continuous numeric target. We present a rigorous and extensible mathematical programming formulation for solving the optimal binning problem for a…

Machine Learning · Computer Science 2022-12-12 Guillermo Navas-Palencia

Ensemble learning, the machine learning paradigm where multiple algorithms are combined, has exhibited promising perfomance in a variety of tasks. The present work focuses on unsupervised ensemble classification. The term unsupervised…

Machine Learning · Computer Science 2020-12-22 Panagiotis A. Traganitis , Georgios B. Giannakis

In this paper, an exact algorithm in polynomial time is developed to solve unrestricted binary quadratic programs. The computational complexity is $O\left( n^{\frac{15}{2}}\right) $, although very conservative, it is sufficient to prove…

Data Structures and Algorithms · Computer Science 2021-02-02 Juan Ignacio Mulero-Martínez

Determining the quality of the results obtained by clustering techniques is a key issue in unsupervised machine learning. Many authors have discussed the desirable features of good clustering algorithms. However, Jon Kleinberg established…

Machine Learning · Computer Science 2019-05-24 Julio-Omar Palacio-Niño , Fernando Berzal

A restricted Boltzmann machine (RBM) is an undirected graphical model constructed for discrete or continuous random variables, with two layers, one hidden and one visible, and no conditional dependency within a layer. In recent years, RBMs…

Machine Learning · Statistics 2019-09-12 Andee Kaplan , Daniel Nordman , Stephen Vardeman

We give an explicit geometric way to build mixed-integer programming (MIP) formulations for unions of polyhedra. The construction is simply described in terms of spanning hyperplanes in an r-dimensional linear space. The resulting MIP…

Optimization and Control · Mathematics 2019-10-11 Joey Huchette , Juan Pablo Vielma

We introduce a new method for training deep Boltzmann machines jointly. Prior methods require an initial learning pass that trains the deep Boltzmann machine greedily, one layer at a time, or do not perform well on classifi- cation tasks.

Machine Learning · Statistics 2012-12-13 Ian Goodfellow , Aaron Courville , Yoshua Bengio

Learning monotonic models with respect to a subset of the inputs is a desirable feature to effectively address the fairness, interpretability, and generalization issues in practice. Existing methods for learning monotonic neural networks…

Machine Learning · Computer Science 2022-12-16 Xingchao Liu , Xing Han , Na Zhang , Qiang Liu

In this work, we present a modeling framework for minimax mixed 0-1 fuzzy linear problems. It is based on extending the usual rewriting of crisp minimax problems via auxiliary variables to model the maximum of a finite set of fuzzy linear…

Optimization and Control · Mathematics 2018-02-21 Manuel Arana-Jiménez , Víctor Blanco

Mixed-integer nonlinear programs (MINLPs) arise in domains such as energy systems, process engineering, and transportation, and are notoriously difficult to solve at scale due to the interplay of discrete decisions and nonlinear…

Machine Learning · Computer Science 2025-12-16 Bo Tang , Elias B. Khalil , Ján Drgoňa

This paper presents Mixed Formal Learning, a new architecture that learns models based on formal mathematical representations of the domain of interest and exposes latent variables. The second element in the architecture learns a particular…

Artificial Intelligence · Computer Science 2019-01-23 Sandra Carrico

Boosting combines weak classifiers to form highly accurate predictors. Although the case of binary classification is well understood, in the multiclass setting, the "correct" requirements on the weak classifier, or the notion of the most…

Machine Learning · Statistics 2011-08-16 Indraneel Mukherjee , Robert E. Schapire

Unsupervised mixture learning (UML) aims at identifying linearly or nonlinearly mixed latent components in a blind manner. UML is known to be challenging: Even learning linear mixtures requires highly nontrivial analytical tools, e.g.,…

Machine Learning · Computer Science 2022-10-17 Qi Lyu , Xiao Fu

This paper introduces the first objective space algorithm which can exactly find all supported and non-supported non-dominated solutions to a mixed-integer multi-objective linear program with an arbitrary number of objective functions. This…

Optimization and Control · Mathematics 2019-09-10 William Pettersson , Melih Ozlen
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