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Atomistic foundation models constitute a paradigm shift in computational materials science by providing universal machine-learned interatomic potentials with broad transferability across chemical spaces. Although fine-tuning is essential…

Computational Physics · Physics 2025-12-08 Xiaoqing Liu , Yangshuai Wang , Teng Zhao

For some typical and widely used non-convex half-quadratic regularization models and the Ambrosio-Tortorelli approximate Mumford-Shah model, based on the Kurdyka-\L ojasiewicz analysis and the recent nonconvex proximal algorithms, we…

Optimization and Control · Mathematics 2021-07-30 Shengxiang Deng , Ismail Ben Ayed , Hongpeng Sun

Preconditioning has long been a staple technique in optimization, often applied to reduce the condition number of a matrix and speed up the convergence of algorithms. Although there are many popular preconditioning techniques in practice,…

Optimization and Control · Mathematics 2022-11-08 Zhaonan Qu , Wenzhi Gao , Oliver Hinder , Yinyu Ye , Zhengyuan Zhou

With the rapid development of natural language processing technology, large-scale language models (LLM) have achieved remarkable results in a variety of tasks. However, how to effectively train these huge models and improve their…

Artificial Intelligence · Computer Science 2024-12-09 Jiajing Chen , Bingying Liu , Xiaoxuan Liao , Jia Gao , Hongye Zheng , Yue Li

First-order optimization algorithms have been proven prominent in deep learning. In particular, algorithms such as RMSProp and Adam are extremely popular. However, recent works have pointed out the lack of ``long-term memory" in Adam-like…

Machine Learning · Computer Science 2020-12-01 Haiwen Huang , Chang Wang , Bin Dong

From a simplified analysis of adaptive methods, we derive AvaGrad, a new optimizer which outperforms SGD on vision tasks when its adaptability is properly tuned. We observe that the power of our method is partially explained by a decoupling…

Machine Learning · Computer Science 2020-03-18 Pedro Savarese , David McAllester , Sudarshan Babu , Michael Maire

Self-supervised learning, a.k.a., pretraining, is important in natural language processing. Most of the pretraining methods first randomly mask some positions in a sentence and then train a model to recover the tokens at the masked…

Computation and Language · Computer Science 2020-08-18 Liang Chen

Improving learning efficiency is paramount for learning resource allocation with deep neural networks (DNNs) in wireless communications over highly dynamic environments. Incorporating domain knowledge into learning is a promising way of…

Signal Processing · Electrical Eng. & Systems 2021-11-12 Chengjian Sun , Jiajun Wu , Chenyang Yang

We describe a novel family of models of multi- layer feedforward neural networks in which the activation functions are encoded via penalties in the training problem. Our approach is based on representing a non-decreasing activation function…

Machine Learning · Computer Science 2018-06-22 Armin Askari , Geoffrey Negiar , Rajiv Sambharya , Laurent El Ghaoui

Deep learning approaches heavily rely on high-quality human supervision which is nonetheless expensive, time-consuming, and error-prone, especially for image segmentation task. In this paper, we propose a method to automatically synthesize…

Computer Vision and Pattern Recognition · Computer Science 2021-12-06 Yu Yang , Hakan Bilen , Qiran Zou , Wing Yin Cheung , Xiangyang Ji

Adam is the go-to optimizer for training modern machine learning models, but it requires additional memory to maintain the moving averages of the gradients and their squares. While various low-memory optimizers have been proposed that…

Machine Learning · Computer Science 2025-03-19 Dayal Singh Kalra , John Kirchenbauer , Maissam Barkeshli , Tom Goldstein

It is widely believed that the backpropagation algorithm is essential for learning good feature detectors in early layers of artificial neural networks, so that these detectors are useful for the task performed by the higher layers of that…

Machine Learning · Computer Science 2019-08-30 Dmitry Krotov , John Hopfield

Discriminative linear models are a popular tool in machine learning. These can be generally divided into two types: The first is linear classifiers, such as support vector machines, which are well studied and provide state-of-the-art…

Machine Learning · Computer Science 2012-07-02 Koby Crammer , Amir Globerson

Adaptive optimization algorithms, such as Adam and RMSprop, have shown better optimization performance than stochastic gradient descent (SGD) in some scenarios. However, recent studies show that they often lead to worse generalization…

Machine Learning · Computer Science 2018-09-19 Zijun Zhang , Lin Ma , Zongpeng Li , Chuan Wu

How does the choice of optimization algorithm shape a model's ability to learn features? To address this question for steepest descent methods --including sign descent, which is closely related to Adam --we introduce steepest mirror flows…

Machine Learning · Computer Science 2026-03-03 Tom Jacobs , Chao Zhou , Rebekka Burkholz

The goal of continual learning is to improve the performance of recognition models in learning sequentially arrived data. Although most existing works are established on the premise of learning from scratch, growing efforts have been…

Computer Vision and Pattern Recognition · Computer Science 2023-10-10 Gengwei Zhang , Liyuan Wang , Guoliang Kang , Ling Chen , Yunchao Wei

We present preconditioned stochastic gradient descent (SGD) algorithms for the $\ell_1$ minimization problem $\min_{x}\|A x - b\|_1$ in the overdetermined case, where there are far more constraints than variables. Specifically, we have $A…

Data Structures and Algorithms · Computer Science 2018-06-04 David Durfee , Kevin A. Lai , Saurabh Sawlani

Deep learning algorithms - typically consisting of a class of deep neural networks trained by a stochastic gradient descent (SGD) optimization method - are nowadays the key ingredients in many artificial intelligence (AI) systems and have…

Machine Learning · Computer Science 2024-07-12 Steffen Dereich , Robin Graeber , Arnulf Jentzen

State-of-the-art training algorithms for deep learning models are based on stochastic gradient descent (SGD). Recently, many variations have been explored: perturbing parameters for better accuracy (such as in Extragradient), limiting SGD…

Machine Learning · Computer Science 2022-03-23 Amirkeivan Mohtashami , Martin Jaggi , Sebastian U. Stich

Traditional analyses in non-convex optimization typically rely on the smoothness assumption, namely requiring the gradients to be Lipschitz. However, recent evidence shows that this smoothness condition does not capture the properties of…

Machine Learning · Computer Science 2022-08-25 Michael Crawshaw , Mingrui Liu , Francesco Orabona , Wei Zhang , Zhenxun Zhuang
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