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The answers to many unsolved problems lie in the intractable chemical space of molecules and materials. Machine learning techniques are rapidly growing in popularity as a way to compress and explore chemical space efficiently. One of the…

Chemical Physics · Physics 2020-01-06 John E. Herr , Kevin Koh , Kun Yao , John Parkhill

Machine learning methods can be a valuable aid in the scientific process, but they need to face challenging settings where data come from inhomogeneous experimental conditions. Recent meta-learning methods have made significant progress in…

Machine Learning · Computer Science 2024-03-21 Matthieu Blanke , Marc Lelarge

Recent developments in applied mathematics increasingly employ machine learning (ML)-particularly supervised learning-to accelerate numerical computations, such as solving nonlinear partial differential equations. In this work, we extend…

Chaotic Dynamics · Physics 2025-09-03 V. R. Tjahjono , S. F. Feng , E. R. M. Putri , H. Susanto

The ability to perform fast and accurate atomistic simulations is crucial for advancing the chemical sciences. By learning from high-quality data, machine-learned interatomic potentials achieve accuracy on par with ab initio and…

Big data and machine learning are driving comprehensive economic and social transformations and are rapidly re-shaping the toolbox and the methodologies of applied scientists. Machine learning tools are designed to learn functions from data…

Fluid Dynamics · Physics 2024-04-16 M. A. Mendez , J. Dominique , M. Fiore , F. Pino , P. Sperotto , J. Van den Berghe

Complex Lie point transformations are used to linearize a class of systems of second order ordinary differential equations (ODEs) which have Lie algebras of maximum dimension $d$, with $d\leq 4$. We identify such a class by employing…

Classical Analysis and ODEs · Mathematics 2015-03-23 Sajid Ali , Muhammad Safdar , Asghar Qadir

Tensors, or multidimensional arrays, are data structures that can naturally represent visual data of multiple dimensions. Inherently able to efficiently capture structured, latent semantic spaces and high-order interactions, tensors have a…

Computer Vision and Pattern Recognition · Computer Science 2021-07-09 Yannis Panagakis , Jean Kossaifi , Grigorios G. Chrysos , James Oldfield , Mihalis A. Nicolaou , Anima Anandkumar , Stefanos Zafeiriou

In an earlier work extensions of supersymmetry and super Lie algebras were constructed consistently starting from any representation $\D$ of any Lie algebra $\g$. Here it is shown how infinite dimensional Lie algebras appear naturally…

High Energy Physics - Theory · Physics 2008-11-26 M. Rausch de Traubenberg

Can we effectively learn a nonlinear representation in time comparable to linear learning? We describe a new algorithm that explicitly and adaptively expands higher-order interaction features over base linear representations. The algorithm…

Machine Learning · Computer Science 2014-10-03 Alekh Agarwal , Alina Beygelzimer , Daniel Hsu , John Langford , Matus Telgarsky

In this article, we discuss some of the recent developments in applying machine learning (ML) techniques to nonlinear dynamical systems. In particular, we demonstrate how to build a suitable ML framework for addressing two specific…

Adaptation and Self-Organizing Systems · Physics 2020-11-30 Sayan Roy , Debanjan Rana

Toroidal Lie algebras are universal central extentions of the finite dimensional simple Lie algbera tensored with Laurent Polynomials in several commuteing variables. In this paper we classify irreducible integrable modules for Toroidal Lie…

Representation Theory · Mathematics 2007-05-23 S. Eswara Rao

Cylindrical algebraic decomposition(CAD) is a key tool in computational algebraic geometry, particularly for quantifier elimination over real-closed fields. When using CAD, there is often a choice for the ordering placed on the variables.…

Symbolic Computation · Computer Science 2014-07-15 Zongyan Huang , Matthew England , David Wilson , James H. Davenport , Lawrence C. Paulson , James Bridge

We construct C-algebras for a class of surfaces that are inverse images of certain polynomials of arbitrary degree. By using the directed graph associated to a matrix, the representation theory can be understood in terms of ``loop'' and…

Mathematical Physics · Physics 2009-11-13 Joakim Arnlind

Learned representations of dynamical systems reduce dimensionality, potentially supporting downstream reinforcement learning (RL). However, no established methods predict a representation's suitability for control and evaluation is largely…

Machine Learning · Computer Science 2020-11-25 Kevin Haninger , Raul Vicente Garcia , Joerg Krueger

Understanding and predicting the emergence of novel materials is a fundamental challenge in condensed matter physics, materials science and technology. With the rapid growth of materials databases in both size and reliability, the challenge…

Materials Science · Physics 2025-02-14 Jacopo Moi , Davide Spallarossa , Stefano Bonetti , Raffaella Burioni , Guido Caldarelli

In this paper we investigate how a typical, large-dimensional representation looks for a complex Lie algebra. In particular, we study the family $\mathfrak{sl}_{r+1}(\mathbb{C})$ of Lie algebras for $r \geq 2$ and derive asymptotic…

Representation Theory · Mathematics 2025-03-05 Walter Bridges , Kathrin Bringmann , Caner Nazaroglu

Constructing good representations is critical for learning complex tasks in a sample efficient manner. In the context of meta-learning, representations can be constructed from common patterns of previously seen tasks so that a future task…

Machine Learning · Computer Science 2021-03-02 Halil Ibrahim Gulluk , Yue Sun , Samet Oymak , Maryam Fazel

This text discusses several popular explanatory methods that go beyond the error measurements and plots traditionally used to assess machine learning models. Some of the explanatory methods are accepted tools of the trade while others are…

Machine Learning · Statistics 2020-06-02 Patrick Hall

Turbulence in fluids, gases, and plasmas remains an open problem of both practical and fundamental importance. Its irreducible complexity usually cannot be tackled computationally in a brute-force style. Here, we combine Large Eddy…

Computational Physics · Physics 2023-09-29 Robin Greif , Frank Jenko , Nils Thuerey

In this paper we show how tensor networks help in developing explainability of machine learning algorithms. Specifically, we develop an unsupervised clustering algorithm based on Matrix Product States (MPS) and apply it in the context of a…

Machine Learning · Computer Science 2025-04-28 Borja Aizpurua , Samuel Palmer , Roman Orus