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Even though neural networks enjoy widespread use, they still struggle to learn the basic laws of physics. How might we endow them with better inductive biases? In this paper, we draw inspiration from Hamiltonian mechanics to train models…

Neural and Evolutionary Computing · Computer Science 2019-09-06 Sam Greydanus , Misko Dzamba , Jason Yosinski

Gaussian process regression is increasingly applied for learning unknown dynamical systems. In particular, the implicit quantification of the uncertainty of the learned model makes it a promising approach for safety-critical applications.…

Machine Learning · Computer Science 2022-06-29 Jan Brüdigam , Martin Schuck , Alexandre Capone , Stefan Sosnowski , Sandra Hirche

We consider the problem of learning the dynamics of a linear system when one has access to data generated by an auxiliary system that shares similar (but not identical) dynamics, in addition to data from the true system. We use a weighted…

Machine Learning · Statistics 2025-01-20 Lei Xin , Lintao Ye , George Chiu , Shreyas Sundaram

We establish connections between the problem of learning a two-layer neural network and tensor decomposition. We consider a model with feature vectors $\boldsymbol x \in \mathbb R^d$, $r$ hidden units with weights $\{\boldsymbol w_i\}_{1\le…

Machine Learning · Computer Science 2018-10-11 Marco Mondelli , Andrea Montanari

We introduce physics informed neural networks -- neural networks that are trained to solve supervised learning tasks while respecting any given law of physics described by general nonlinear partial differential equations. In this two part…

Artificial Intelligence · Computer Science 2017-11-30 Maziar Raissi , Paris Perdikaris , George Em Karniadakis

The power of multivariate functions is their ability to model a wide variety of phenomena, but have the disadvantages that they lack an intuitive or interpretable representation, and often require a (very) large number of parameters. We…

Numerical Analysis · Computer Science 2018-05-23 Philippe Dreesen , Jeroen De Geeter , Mariya Ishteva

The paradigm of linear structural equation modeling readily allows one to incorporate causal feedback loops in the model specification. These appear as directed cycles in the common graphical representation of the models. However, the…

Statistics Theory · Mathematics 2025-07-16 Mathias Drton , Marina Garrote-López , Niko Nikov , Elina Robeva , Y. Samuel Wang

Machine learning of scalar molecular properties such as potential energy has enabled widespread applications. However, there are relatively few machine learning models targeting directional properties, including permanent and transition…

Chemical Physics · Physics 2021-11-10 Yaolong Zhang , Jun Jiang , Bin Jiang

Conservation laws are key theoretical and practical tools for understanding, characterizing, and modeling nonlinear dynamical systems. However, for many complex systems, the corresponding conserved quantities are difficult to identify,…

Computational Physics · Physics 2023-08-23 Peter Y. Lu , Rumen Dangovski , Marin Soljačić

Analyzing data from dynamical systems often begins with creating a reconstruction of the trajectory based on one or more variables, but not all variables are suitable for reconstructing the trajectory. The concept of nonlinear observability…

Chaotic Dynamics · Physics 2018-10-25 Thomas L. Carroll

Geophysical inversion attempts to estimate the distribution of physical properties in the Earth's interior from observations collected at or above the surface. Inverse problems are commonly posed as least-squares optimization problems in…

Geophysics · Physics 2019-05-22 Vladimir Puzyrev

We consider the learning of algorithmic tasks by mere observation of input-output pairs. Rather than studying this as a black-box discrete regression problem with no assumption whatsoever on the input-output mapping, we concentrate on tasks…

Machine Learning · Computer Science 2018-10-16 Alex Nowak-Vila , David Folqué , Joan Bruna

This paper proposes a data-driven learning framework for identifying governing laws of generalized diffusions with non-gradient components. By combining energy dissipation laws with a physically consistent penalty and first-moment…

Computational Physics · Physics 2025-08-11 Fanze Kong , Chen-Chih Lai , Yubin Lu

Humans gain an implicit understanding of physical laws through observing and interacting with the world. Endowing an autonomous agent with an understanding of physical laws through experience and observation is seldom practical: we should…

Computational Physics · Physics 2018-12-06 Wilhelm E. Sorteberg , Stef Garasto , Alison S. Pouplin , Chris D. Cantwell , Anil A. Bharath

Many real-world systems, such as moving planets, can be considered as multi-agent dynamic systems, where objects interact with each other and co-evolve along with the time. Such dynamics is usually difficult to capture, and understanding…

Machine Learning · Computer Science 2020-11-10 Zijie Huang , Yizhou Sun , Wei Wang

Machine learning has become increasingly popular for efficiently modelling the dynamics of complex physical systems, demonstrating a capability to learn effective models for dynamics which ignore redundant degrees of freedom. Learned…

Machine Learning · Computer Science 2022-11-29 Ameya Daigavane , Arthur Kosmala , Miles Cranmer , Tess Smidt , Shirley Ho

The laws of physics have been written in the language of dif-ferential equations for centuries. Neural Ordinary Differen-tial Equations (NODEs) are a new machine learning architecture which allows these differential equations to be learned…

Machine Learning · Computer Science 2021-09-20 Max Zhu , Pietro Lio , Jacob Moss

Is a deep learning model capable of understanding systems governed by certain first principle laws by only observing the system's output? Can deep learning learn the underlying physics and honor the physics when making predictions? The…

Computational Physics · Physics 2020-06-11 Rohan Thavarajah , Xiang Zhai , Zheren Ma , David Castineira

While data-driven methods offer significant promise for modeling complex materials, they often face challenges in generalizing across diverse physical scenarios and maintaining physical consistency. To address these limitations, we propose…

Graphics · Computer Science 2025-10-27 Xueguang Xie , Shu Yan , Shiwen Jia , Siyu Yang , Aimin Hao , Yang Gao , Peng Yu

Near-term prediction of the structured spatio-temporal processes driving our climate is of profound importance to the safety and well-being of millions, but the prounced nonlinear convection of these processes make a complete mechanistic…

Computational Physics · Physics 2020-06-30 Daniel J. Tait