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Nuclear materials are often demanded to function for extended time in extreme environments, including high radiation fluxes and transmutation, high temperature and temperature gradients, stresses, and corrosive coolants. They also have a…

Materials Science · Physics 2022-11-18 Dane Morgan , Ghanshyam Pilania , Adrien Couet , Blas P. Uberuaga , Cheng Sun , Ju Li

Large language models (LLMs) are increasingly being used in materials science. However, little attention has been given to benchmarking and standardized evaluation for LLM-based materials property prediction, which hinders progress. We…

Materials Science · Physics 2024-12-03 Andre Niyongabo Rubungo , Kangming Li , Jason Hattrick-Simpers , Adji Bousso Dieng

Reinforcement fine-tuning played an instrumental role in enhancing the instruction-following and reasoning abilities of large language models. In this work, we employ reinforcement fine-tuning for materials design, in which discriminative…

Materials Science · Physics 2026-01-19 Zhendong Cao , Lei Wang

Material classification has emerged as a critical task in computer vision and graphics, supporting the assignment of accurate material properties to a wide range of digital and real-world applications. While traditionally framed as an image…

Computer Vision and Pattern Recognition · Computer Science 2026-03-19 Qingran Lin , Fengwei Yang , Chaolun Zhu

Vision-language models (VLMs) have demonstrated exceptional generalization capabilities for downstream tasks. Due to its efficiency, prompt learning has gradually become a more effective and efficient method for transferring VLMs to…

Computer Vision and Pattern Recognition · Computer Science 2026-05-12 Chenhao Ding , Xinyuan Gao , Songlin Dong , Jizhou Han , Qiang Wang , Zhengdong Zhou , Yuhang He , Yihong Gong

Proteins adopt multiple structural conformations to perform their diverse biological functions, and understanding these conformations is crucial for advancing drug discovery. Traditional physics-based simulation methods often struggle with…

Biomolecules · Quantitative Biology 2025-03-14 Jiarui Lu , Xiaoyin Chen , Stephen Zhewen Lu , Chence Shi , Hongyu Guo , Yoshua Bengio , Jian Tang

Information-seeking is a core capability for AI agents, requiring them to gather and reason over tool-generated information across long trajectories. However, such multi-step information-seeking tasks remain challenging for agents backed by…

Artificial Intelligence · Computer Science 2025-11-25 Jaewoo Lee , Archiki Prasad , Justin Chih-Yao Chen , Zaid Khan , Elias Stengel-Eskin , Mohit Bansal

With the growing demand for novel materials, machine learning-driven inverse design methods face significant challenges in reconciling the high-dimensional materials composition space with limited experimental data. Existing approaches…

Machine Learning · Computer Science 2025-07-02 Yeyong Yu , Xilei Bian , Jie Xiong , Xing Wu , Quan Qian

Large language models (LLMs) exhibit substantial potential across diverse scientific disciplines, including materials science. A property prediction framework, ZEBRA-Prop (Zero-Shot Embedding-Based Rapid and Accessible Regression Model for…

Materials Science · Physics 2026-03-30 Ryoma Yamamoto , Akira Takahashi , Kei Terayama , Yu Kumagai , Fumiyasu Oba

Recent studies have revealed the intriguing few-shot learning ability of pretrained language models (PLMs): They can quickly adapt to a new task when fine-tuned on a small amount of labeled data formulated as prompts, without requiring…

Computation and Language · Computer Science 2023-05-15 Yu Meng , Martin Michalski , Jiaxin Huang , Yu Zhang , Tarek Abdelzaher , Jiawei Han

Large Language Models (LLMs) represent a promising frontier for recommender systems, yet their development has been impeded by the absence of predictable scaling laws, which are crucial for guiding research and optimizing resource…

Information Retrieval · Computer Science 2026-02-16 Benyu Zhang , Qiang Zhang , Jianpeng Cheng , Hong-You Chen , Qifei Wang , Wei Sun , Shen Li , Jia Li , Jiahao Wu , Xiangjun Fan , Hong Yan

Despite exceptional capabilities, Large Language Models (LLMs) still face deployment challenges due to their enormous size. Post-training structured pruning is a promising solution that prunes LLMs without the need for retraining, reducing…

Machine Learning · Computer Science 2025-02-21 Weizhong Huang , Yuxin Zhang , Xiawu Zheng , Fei Chao , Rongrong Ji

Reinforcement learning (RL) has become the de facto standard practice for sequential decision-making problems by improving future acting policies with feedback. However, RL algorithms may require extensive trial-and-error interactions to…

Machine Learning · Computer Science 2024-02-27 Shenao Zhang , Sirui Zheng , Shuqi Ke , Zhihan Liu , Wanxin Jin , Jianbo Yuan , Yingxiang Yang , Hongxia Yang , Zhaoran Wang

We study model pruning methods applied to Transformer-based neural network language models for automatic speech recognition. We explore three aspects of the pruning frame work, namely criterion, method and scheduler, analyzing their…

Machine Learning · Computer Science 2023-10-06 Leonardo Emili , Thiago Fraga-Silva , Ernest Pusateri , Markus Nußbaum-Thom , Youssef Oualil

Large Language Models (LLMs) exhibit strong reasoning abilities, but their high computational costs limit their practical deployment. Recent studies reveal significant redundancy in LLMs layers, making layer pruning an active research…

Computation and Language · Computer Science 2026-02-17 Hao Liu , Guangyan Li , Wensheng Zhang , Yongqiang Tang

Multivariate time series classification supports applications from wearable sensing to biomedical monitoring and demands models that can capture both short-term patterns and multi-scale temporal dependencies. Despite recent advances,…

Machine Learning · Computer Science 2026-04-07 Federico Zucchi , Thomas Lampert

Large Language Models (LLMs) have achieved remarkable success across a wide spectrum of natural language processing tasks. However, their ever-growing scale introduces significant barriers to real-world deployment, including substantial…

Computation and Language · Computer Science 2026-01-07 Guangxin Wu , Hao Zhang , Zhang Zhibin , Jiafeng Guo , Xueqi Cheng

Non-uniform structured network pruning methods can effectively reduce Large Language Model (LLM) size by eliminating redundant channels or layers, offering lower performance degradation than uniform strategies. However, existing non-uniform…

Machine Learning · Computer Science 2025-08-07 Zuxin Ma , Yunhe Cui , Yongbin Qin

The breakthrough performance of large language models (LLMs) comes with major computational footprints and high deployment costs. In this paper, we progress towards resolving this problem by proposing a novel structured compression approach…

Machine Learning · Computer Science 2023-10-27 Eldar Kurtic , Elias Frantar , Dan Alistarh

Large Language Models (LLMs) are widely deployed in diverse real-world settings, yet remain vulnerable to jailbreaking, where prompt-based attacks bypass safety filters. We present THREAT (Targeted Harmful generation via Reframing and…

Cryptography and Security · Computer Science 2026-05-22 Shahnewaz Karim Sakib , Swati Kar , Anindya Bijoy Das
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