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Machine learning has revolutionized polymer science by enabling rapid property prediction and generative design. Large language models (LLMs) offer further opportunities in polymer informatics by simplifying workflows that traditionally…

Computational Engineering, Finance, and Science · Computer Science 2026-02-20 Sonakshi Gupta , Akhlak Mahmood , Shivank Shukla , Rampi Ramprasad

Summarization is a core task in Natural Language Processing (NLP). Recent advances in Large Language Models (LLMs) and the introduction of large context windows reaching millions of tokens make it possible to process entire books in a…

Computation and Language · Computer Science 2026-03-12 Tairan Fu , Javier Conde , Pedro Reviriego , Javier Coronado-Blázquez , Nina Melero , Elena Merino-Gómez

Large language models (LLMs) excel on a variety of reasoning benchmarks, but previous studies suggest they sometimes struggle to generalize to unseen questions, potentially due to over-reliance on memorized training examples. However, the…

Computation and Language · Computer Science 2025-04-01 Yihuai Hong , Dian Zhou , Meng Cao , Lei Yu , Zhijing Jin

Previous literatures show that pre-trained masked language models (MLMs) such as BERT can achieve competitive factual knowledge extraction performance on some datasets, indicating that MLMs can potentially be a reliable knowledge source. In…

Computation and Language · Computer Science 2021-06-18 Boxi Cao , Hongyu Lin , Xianpei Han , Le Sun , Lingyong Yan , Meng Liao , Tong Xue , Jin Xu

Several machine learning methods aim to learn or reason about complex physical systems. A common first-step towards reasoning is to infer system parameters from observations of its behavior. In this paper, we investigate the performance of…

Computation and Language · Computer Science 2024-02-07 Sean Memery , Mirella Lapata , Kartic Subr

Intelligent systems must maintain and manipulate task-relevant information online to adapt to dynamic environments and changing goals. This capacity, known as working memory, is fundamental to human reasoning and intelligence. Despite…

Machine Learning · Computer Science 2026-04-14 Hua-Dong Xiong , Li Ji-An , Jiaqi Huang , Robert C. Wilson , Kwonjoon Lee , Xue-Xin Wei

Large Language Models (LLMs) represent a class of deep learning models adept at understanding natural language and generating coherent responses to various prompts or queries. These models far exceed the complexity of conventional neural…

Machine Learning · Computer Science 2024-12-05 Minghao Shao , Abdul Basit , Ramesh Karri , Muhammad Shafique

What factors contribute to the relative success and corresponding difficulties of in-context learning for Large Language Models (LLMs)? Drawing on insights from the literature on human concept learning, we test LLMs on carefully designed…

Computation and Language · Computer Science 2024-12-05 Leroy Z. Wang , R. Thomas McCoy , Shane Steinert-Threlkeld

Large language models (LLMs) exhibit remarkable flexibility: they can adapt to novel tasks from in-context examples without any parameter updates, a capability known as in-context learning (ICL). Prior work on synthetic tasks has shown that…

Computation and Language · Computer Science 2026-05-29 Hua-Dong Xiong , Li Ji-An , Robert C. Wilson , Kwonjoon Lee , Xue-Xin Wei

In this study, we propose an axiomatic system to define and quantify the precise memorization and in-context reasoning effects used by the large language model (LLM) for language generation. These effects are formulated as non-linear…

Machine Learning · Computer Science 2024-05-21 Siyu Lou , Yuntian Chen , Xiaodan Liang , Liang Lin , Quanshi Zhang

Large Language Models (LLMs) have demonstrated remarkable success in various tasks such as natural language understanding, text summarization, and machine translation. However, their general-purpose nature often limits their effectiveness…

Computation and Language · Computer Science 2025-09-03 Zirui Song , Bin Yan , Yuhan Liu , Miao Fang , Mingzhe Li , Rui Yan , Xiuying Chen

Large Language Models (LLMs) are rapidly reshaping machine translation (MT), particularly by introducing instruction-following, in-context learning, and preference-based alignment into what has traditionally been a supervised…

Computation and Language · Computer Science 2026-04-29 Baban Gain , Dibyanayan Bandyopadhyay , Asif Ekbal , Trilok Nath Singh

Large Language Models (LLMs) have made significant strides in handling long sequences. Some models like Gemini could even to be capable of dealing with millions of tokens. However, their performance evaluation has largely been confined to…

Computation and Language · Computer Science 2024-06-13 Tianle Li , Ge Zhang , Quy Duc Do , Xiang Yue , Wenhu Chen

The training of modern large language models (LLMs) takes place in a regime where most training examples are seen only a few times by the model during the course of training. What does a model remember about such examples seen only a few…

Computation and Language · Computer Science 2023-03-31 A. Emin Orhan

Predicting future events is an important activity with applications across multiple fields and domains. For example, the capacity to foresee stock market trends, natural disasters, business developments, or political events can facilitate…

Computation and Language · Computer Science 2025-01-13 Petraq Nako , Adam Jatowt

Large language models (LLMs) tend to inadequately integrate input context during text generation, relying excessively on encoded prior knowledge in model parameters, potentially resulting in generated text with factual inconsistencies or…

Computation and Language · Computer Science 2024-05-07 Zheng Zhao , Emilio Monti , Jens Lehmann , Haytham Assem

Vector embeddings derived from large language models (LLMs) show promise in capturing latent information from the literature. Interestingly, these can be integrated into material embeddings, potentially useful for data-driven predictions of…

Computation and Language · Computer Science 2024-09-19 Luke P. J. Gilligan , Matteo Cobelli , Hasan M. Sayeed , Taylor D. Sparks , Stefano Sanvito

The real estate market is vital to global economies but suffers from significant information asymmetry. This study examines how Large Language Models (LLMs) can democratize access to real estate insights by generating competitive and…

Artificial Intelligence · Computer Science 2025-10-01 Margot Geerts , Manon Reusens , Bart Baesens , Seppe vanden Broucke , Jochen De Weerdt

Large Language Models (LLMs) are prone to generating fluent but incorrect content, known as confabulation, which poses increasing risks in multi-turn or agentic applications where outputs may be reused as context. In this work, we…

Computation and Language · Computer Science 2026-03-18 Tianyi Zhou , Johanne Medina , Sanjay Chawla

Previous works show that Pre-trained Language Models (PLMs) can capture factual knowledge. However, some analyses reveal that PLMs fail to perform it robustly, e.g., being sensitive to the changes of prompts when extracting factual…

Computation and Language · Computer Science 2022-10-21 Shaobo Li , Xiaoguang Li , Lifeng Shang , Chengjie Sun , Bingquan Liu , Zhenzhou Ji , Xin Jiang , Qun Liu
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