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In this study, we evaluate several classifiers and focus on selecting a minimal set of appropriate material features. Our objective is to propose and discuss general strategies for reducing the number of descriptors required for material…

Other Condensed Matter · Physics 2025-10-01 Giovanni Trezza , Eliodoro Chiavazzo

As data sets continue to grow in size and complexity, effective and efficient techniques are needed to target important features in the variable space. Many of the variable selection techniques that are commonly used alongside clustering…

Computation · Statistics 2013-03-22 Jeffrey L. Andrews , Paul D. McNicholas

Abstract Machine learning models, trained on data from ab initio quantum simulations, are yielding molecular dynamics potentials with unprecedented accuracy. One limiting factor is the quantity of available training data, which can be…

Computational Physics · Physics 2020-06-11 Justin S. Smith , Nicholas Lubbers , Aidan P. Thompson , Kipton Barros

This paper discusses predictive inference and feature selection for generalized linear models with scarce but high-dimensional data. We argue that in many cases one can benefit from a decision theoretically justified two-stage approach:…

Machine Learning · Statistics 2020-11-09 Juho Piironen , Markus Paasiniemi , Aki Vehtari

Purpose: Machine learning is broadly used for clinical data analysis. Before training a model, a machine learning algorithm must be selected. Also, the values of one or more model parameters termed hyper-parameters must be set. Selecting…

Machine Learning · Computer Science 2018-12-10 Xueqiang Zeng , Gang Luo

While there is currently a lot of enthusiasm about "big data", useful data is usually "small" and expensive to acquire. In this paper, we present a new paradigm of learning partial differential equations from {\em small} data. In…

Artificial Intelligence · Computer Science 2018-01-17 Maziar Raissi , George Em Karniadakis

Given the cost, both financial and even more importantly in terms of human effort, in building High Energy Physics accelerators and detectors and running them, it is important to use good statistical techniques in analysing data. Some of…

High Energy Physics - Experiment · Physics 2014-09-08 Louis Lyons

The likelihood function plays a crucial role in statistical inference and experimental design. However, it is computationally intractable for several important classes of statistical models, including energy-based models and simulator-based…

Machine Learning · Computer Science 2022-05-02 Michael U. Gutmann , Steven Kleinegesse , Benjamin Rhodes

In many real-world scenarios where data is high dimensional, test time acquisition of features is a non-trivial task due to costs associated with feature acquisition and evaluating feature value. The need for highly confident models with an…

Machine Learning · Computer Science 2019-09-17 Orpaz Goldstein , Mohammad Kachuee , Kimmo Karkkainen , Majid Sarrafzadeh

The unit selection problem is to identify a group of individuals who are most likely to exhibit a desired mode of behavior, for example, selecting individuals who would respond one way if incentivized and a different way if not. The unit…

Artificial Intelligence · Computer Science 2022-10-18 Ang Li , Song Jiang , Yizhou Sun , Judea Pearl

Feature importance ranking has become a powerful tool for explainable AI. However, its nature of combinatorial optimization poses a great challenge for deep learning. In this paper, we propose a novel dual-net architecture consisting of…

Machine Learning · Computer Science 2020-10-20 Maksymilian Wojtas , Ke Chen

A novel model of the data selection, acquisition and analysis for a multi-purpose and multi-component high-energy-physics experiment is presented. Its departure point is the freedom and the responsibility given to the different physics…

High Energy Physics - Experiment · Physics 2008-12-19 Mieczyslaw Witold Krasny

The fact that we can build models from data, and therefore refine our models with more data from experiments, is usually given for granted in scientific inquiry. However, how much information can we extract, and how precise can we expect…

Nuclear Theory · Physics 2022-11-14 Andrea Idini

In supervised machine learning, feature selection plays a very important role by potentially enhancing explainability and performance as measured by computing time and accuracy-related metrics. In this paper, we investigate a method for…

Machine Learning · Computer Science 2024-02-02 Raisa Islam , Subhasish Mazumdar , Rakibul Islam

Feature selection is essential for effective visual recognition. We propose an efficient joint classifier learning and feature selection method that discovers sparse, compact representations of input features from a vast sea of candidates,…

Computer Vision and Pattern Recognition · Computer Science 2015-12-03 Marius Leordeanu , Alexandra Radu , Shumeet Baluja , Rahul Sukthankar

Statistical system models provide the basis for the examination of various sorts of distributions. Classification distributions are a very common and versatile form of statistics in e.g. real economic, social, and IT systems. The…

Computation · Statistics 2019-12-20 Uwe Petersohn , Thomas Dedek , Sandra Zimmer , Hans Biskupski

We develop, discuss, and compare several inference techniques to constrain theory parameters in collider experiments. By harnessing the latent-space structure of particle physics processes, we extract extra information from the simulator.…

High Energy Physics - Phenomenology · Physics 2018-09-19 Johann Brehmer , Kyle Cranmer , Gilles Louppe , Juan Pavez

Continual learning is an emerging paradigm in machine learning, wherein a model is exposed in an online fashion to data from multiple different distributions (i.e. environments), and is expected to adapt to the distribution change.…

Machine Learning · Computer Science 2022-03-29 Binghui Peng , Andrej Risteski

Deep learning, a branch of machine learning, have been recently applied to high energy experimental and phenomenological studies. In this note we give a brief review on those applications using supervised deep learning. We first describe…

High Energy Physics - Phenomenology · Physics 2019-09-04 Murat Abdughani , Jie Ren , Lei Wu , Jin Min Yang , Jun Zhao

In this paper we propose ways to incorporate Machine Learning training outputs into a study of statistical significance. We describe these methods in supervised classification tasks using a CNN and a DNN output, and unsupervised learning…

High Energy Physics - Phenomenology · Physics 2022-03-09 Charanjit K. Khosa , Veronica Sanz , Michael Soughton