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Recently, machine learning methods have gained significant traction in scientific computing, particularly for solving Partial Differential Equations (PDEs). However, methods based on deep neural networks (DNNs) often lack convergence…

Artificial Intelligence · Computer Science 2025-06-16 Li Liu , Heng Yong

Networks are ubiquitous structure that describes complex relationships between different entities in the real world. As a critical component of prediction task over nodes in networks, learning the feature representation of nodes has become…

Machine Learning · Computer Science 2018-09-10 Hansheng Xue , Jiajie Peng , Xuequn Shang

The inapplicability of amino acid covariation methods to small protein families has limited their use for structural annotation of whole genomes. Recently, deep learning has shown promise in allowing accurate residue-residue contact…

Biomolecules · Quantitative Biology 2019-09-10 Joe G Greener , Shaun M Kandathil , David T Jones

Multiscale dynamical systems, modeled by high-dimensional stiff ordinary differential equations (ODEs) with wide-ranging characteristic timescales, arise across diverse fields of science and engineering, but their numerical solvers often…

Numerical Analysis · Mathematics 2025-08-14 Junjie Yao , Yuxiao Yi , Liangkai Hang , Weinan E , Weizong Wang , Yaoyu Zhang , Tianhan Zhang , Zhi-Qin John Xu

This work contributes to the development of a new data-driven method (D-DM) of feedforward neural networks (FNNs) learning. This method was proposed recently as a way of improving randomized learning of FNNs by adjusting the network…

Machine Learning · Computer Science 2021-07-07 Grzegorz Dudek

Dynamical system models such as Recurrent Neural Networks (RNNs) have become increasingly popular as hypothesis-generating tools in scientific research. Evaluating the dynamics in such networks is key to understanding their learned…

Machine Learning · Computer Science 2024-02-16 Ruiqi Chen , Giacomo Vedovati , Todd Braver , ShiNung Ching

Neural-based multi-task learning (MTL) has been successfully applied to many recommendation applications. However, these MTL models (e.g., MMoE, PLE) did not consider feature interaction during the optimization, which is crucial for…

Predicting the resilience of complex networks, which represents the ability to retain fundamental functionality amidst external perturbations or internal failures, plays a critical role in understanding and improving real-world complex…

Artificial Intelligence · Computer Science 2024-08-20 Chang Liu , Jingtao Ding , Yiwen Song , Yong Li

Deep neural network learning can be formulated as a non-convex optimization problem. Existing optimization algorithms, e.g., Adam, can learn the models fast, but may get stuck in local optima easily. In this paper, we introduce a novel…

Machine Learning · Computer Science 2019-03-12 Jiawei Zhang , Fisher B. Gouza

Neural networks are one tool for approximating non-linear differential equations used in scientific computing tasks such as surrogate modeling, real-time predictions, and optimal control. PDE foundation models utilize neural networks to…

Machine Learning · Computer Science 2025-02-11 Elisa Negrini , Yuxuan Liu , Liu Yang , Stanley J. Osher , Hayden Schaeffer

Artificial neural networks (ANNs), inspired by the interconnection of real neurons, have achieved unprecedented success in various fields such as computer vision and natural language processing. Recently, a novel mathematical ANN model,…

Neural and Evolutionary Computing · Computer Science 2023-09-15 Yu Ding , Jun Yu , Chunzhi Gu , Shangce Gao , Chao Zhang

This paper investigates the learnability of the nonlinearity property of Boolean functions using neural networks. We train encoder style deep neural networks to learn to predict the nonlinearity of Boolean functions from examples of…

Machine Learning · Computer Science 2025-02-04 Sriram Ranga , Nandish Chattopadhyay , Anupam Chattopadhyay

Dendrites are crucial structures for computation of an individual neuron. It has been shown that the dynamics of a biological neuron with dendrites can be approximated by artificial neural networks (ANN) with deep structure. However, it…

Neurons and Cognition · Quantitative Biology 2023-05-23 Jingyang Ma , Songting Li , Douglas Zhou

Deep learning has exhibited remarkable results across diverse areas. To understand its success, substantial research has been directed towards its theoretical foundations. Nevertheless, the majority of these studies examine how well deep…

Machine Learning · Statistics 2024-06-11 Hao Liu , Jiahui Cheng , Wenjing Liao

Complex biological systems have been successfully modeled by biochemical and genetic interaction networks, typically gathered from high-throughput (HTP) data. These networks can be used to infer functional relationships between genes or…

Molecular Networks · Quantitative Biology 2015-04-13 Hyunghoon Cho , Bonnie Berger , Jian Peng

Dynamical systems models such as recurrent neural networks (RNNs) are increasingly popular in theoretical neuroscience for hypothesis-generation and data analysis. Evaluating the dynamics in such models is key to understanding their learned…

Machine Learning · Computer Science 2026-05-28 Ruiqi Chen , Giacomo Vedovati , Todd Braver , ShiNung Ching

Many complex real-world tasks are composed of several levels of sub-tasks. Humans leverage these hierarchical structures to accelerate the learning process and achieve better generalization. In this work, we study the inductive bias and…

Machine Learning · Computer Science 2021-03-23 Yuchen Lu , Yikang Shen , Siyuan Zhou , Aaron Courville , Joshua B. Tenenbaum , Chuang Gan

Deep learning (DL) allows computer models to learn, visualize, optimize, refine, and predict data. To understand its present state, examining the most recent advancements and applications of deep learning across various domains is…

Deep learning models such as Convolutional Neural Networks (CNNs) have demonstrated high levels of effectiveness in a variety of domains, including computer vision and more recently, computational biology. However, training effective models…

Machine Learning · Computer Science 2020-12-01 Udai G. Nagpal , David A Knowles

Deciphering protein function remains a fundamental challenge in protein representation learning. The task presents significant difficulties for protein language models (PLMs) due to the sheer volume of functional annotation categories and…

Biomolecules · Quantitative Biology 2025-06-10 Zixuan Jiang , Renjing Xu