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Machine learning (ML) in the representation of molecular-orbital-based (MOB) features has been shown to be an accurate and transferable approach to the prediction of post-Hartree-Fock correlation energies. Previous applications of MOB-ML…

Chemical Physics · Physics 2023-03-28 Lixue Cheng , Nikola B. Kovachki , Matthew Welborn , Thomas F. Miller

Bayesian optimization is popular for optimizing time-consuming black-box objectives. Nonetheless, for hyperparameter tuning in deep neural networks, the time required to evaluate the validation error for even a few hyperparameter settings…

Machine Learning · Computer Science 2019-03-13 Jian Wu , Saul Toscano-Palmerin , Peter I. Frazier , Andrew Gordon Wilson

Considering grant-free transmissions in low-power IoT networks with unknown time-frequency distribution of interference, we address the problem of Dynamic Resource Configuration (DRC), which amounts to a Markov decision process.…

Information Theory · Computer Science 2021-06-08 Yang Huang , Caiyong Hao , Yijie Mao , Fuhui Zhou

The process of meta-learning algorithms from data, instead of relying on manual design, is growing in popularity as a paradigm for improving the performance of machine learning systems. Meta-learning shows particular promise for…

Machine Learning · Computer Science 2025-09-11 Alexander David Goldie , Zilin Wang , Jaron Cohen , Jakob Nicolaus Foerster , Shimon Whiteson

In Multi-objective Reinforcement Learning (MORL) agents are tasked with optimising decision-making behaviours that trade-off between multiple, possibly conflicting, objectives. MORL based on decomposition is a family of solution methods…

Machine Learning · Computer Science 2025-06-17 Yucheng Shi , David Lynch , Alexandros Agapitos

In recent years, model-agnostic meta-learning (MAML) has become a popular research area. However, the stochastic optimization of MAML is still underdeveloped. Existing MAML algorithms rely on the ``episode'' idea by sampling a few tasks and…

Machine Learning · Computer Science 2023-04-26 Bokun Wang , Zhuoning Yuan , Yiming Ying , Tianbao Yang

Continual fine-tuning of Large Language Models (LLMs) is hampered by the trade-off between efficiency and expressiveness. Low-Rank Adaptation (LoRA) offers efficiency but constrains the model's ability to learn new tasks and transfer…

Machine Learning · Computer Science 2025-07-08 Chenxu Wang , Yilin Lyu , Zicheng Sun , Liping Jing

Low-Rank Adaptation (LoRA) drives research to align its performance with full fine-tuning. However, significant challenges remain: (1) Simply increasing the rank size of LoRA does not effectively capture high-rank information, which leads…

Machine Learning · Computer Science 2024-10-21 Chuanyu Tang , Yilong Chen , Zhenyu Zhang , Junyuan Shang , Wenyuan Zhang , Yong Huang , Tingwen Liu

Machine learning (ML) methods, which fit to data the parameters of a given parameterized model class, have garnered significant interest as potential methods for learning surrogate models for complex engineering systems for which…

Machine Learning · Statistics 2024-07-03 Elizabeth Qian , Dayoung Kang , Vignesh Sella , Anirban Chaudhuri

We study reinforcement learning with multinomial logistic (MNL) function approximation where the underlying transition probability kernel of the Markov decision processes (MDPs) is parametrized by an unknown transition core with features of…

Machine Learning · Statistics 2024-11-01 Wooseong Cho , Taehyun Hwang , Joongkyu Lee , Min-hwan Oh

Applying Machine Learning (ML) techniques to design and optimize computer architectures is a promising research direction. Optimizing the runtime performance of a Network-on-Chip (NoC) necessitates a continuous learning framework. In this…

Networking and Internet Architecture · Computer Science 2019-08-14 Sheng-Chun Kao , Chao-Han Huck Yang , Pin-Yu Chen , Xiaoli Ma , Tushar Krishna

We introduce a model-based image reconstruction framework with a convolution neural network (CNN) based regularization prior. The proposed formulation provides a systematic approach for deriving deep architectures for inverse problems with…

Computer Vision and Pattern Recognition · Computer Science 2019-06-06 Hemant Kumar Aggarwal , Merry P. Mani , Mathews Jacob

Parameter-efficient transfer learning (PETL) has emerged as a flourishing research field for adapting large pre-trained models to downstream tasks, greatly reducing trainable parameters while grappling with memory challenges during…

Computer Vision and Pattern Recognition · Computer Science 2024-07-11 Haiwen Diao , Bo Wan , Xu Jia , Yunzhi Zhuge , Ying Zhang , Huchuan Lu , Long Chen

Deep learning-based Magnetic Resonance (MR) reconstruction methods have focused on generating high-quality images but often overlook the impact on downstream tasks (e.g., segmentation) that utilize the reconstructed images. Cascading…

Image and Video Processing · Electrical Eng. & Systems 2025-06-25 Hwihun Jeong , Se Young Chun , Jongho Lee

Optimizing a reinforcement learning (RL) policy typically requires extensive interactions with a high-fidelity simulator of the environment, which are often costly or impractical. Offline RL addresses this problem by allowing training from…

Machine Learning · Computer Science 2025-09-19 Houssem Sifaou , Osvaldo Simeone

In recent years, Convolutional Neural Networks (CNNs) have enabled significant advancements to the state-of-the-art in computer vision. For classification tasks, CNNs have widely employed probabilistic output and have shown the significance…

Computer Vision and Pattern Recognition · Computer Science 2020-08-11 Muhammad Asad , Rilwan Basaru , S M Masudur Rahman Al Arif , Greg Slabaugh

The performance of a Convolutional Neural Network (CNN) depends on its hyperparameters, like the number of layers, kernel sizes, or the learning rate for example. Especially in smaller networks and applications with limited computational…

Computer Vision and Pattern Recognition · Computer Science 2019-05-07 Lukas Hahn , Lutz Roese-Koerner , Klaus Friedrichs , Anton Kummert

Lack of performance when it comes to continual learning over non-stationary distributions of data remains a major challenge in scaling neural network learning to more human realistic settings. In this work we propose a new conceptualization…

Machine Learning · Computer Science 2019-05-06 Matthew Riemer , Ignacio Cases , Robert Ajemian , Miao Liu , Irina Rish , Yuhai Tu , Gerald Tesauro

Multimodal Continual Instruction Tuning (MCIT) aims to finetune Multimodal Large Language Models (MLLMs) to continually align with human intent across sequential tasks. Existing approaches often rely on the Mixture-of-Experts (MoE) LoRA…

Computation and Language · Computer Science 2025-06-04 Duzhen Zhang , Yong Ren , Zhong-Zhi Li , Yahan Yu , Jiahua Dong , Chenxing Li , Zhilong Ji , Jinfeng Bai

Recent state-of-the-art language models utilize a two-phase training procedure comprised of (i) unsupervised pre-training on unlabeled text, and (ii) fine-tuning for a specific supervised task. More recently, many studies have been focused…

Computation and Language · Computer Science 2019-11-15 Itzik Malkiel , Lior Wolf
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