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Applications of machine learning in chemistry are often limited by the scarcity and expense of labeled data, restricting traditional supervised methods. In this work, we introduce a framework for molecular reasoning using general-purpose…

Large Language Models (LLMs) have recently demonstrated remarkable reasoning abilities, yet hallucinate on knowledge-intensive tasks. Retrieval-augmented generation (RAG) mitigates this issue by grounding answers in external sources, e.g.,…

Computation and Language · Computer Science 2026-01-29 Kaehyun Um , KyuHwan Yeom , Haerim Yang , Minyoung Choi , Hyeongjun Yang , Kyong-Ho Lee

In this technical report, we introduce OpenR, an open-source framework designed to integrate key components for enhancing the reasoning capabilities of large language models (LLMs). OpenR unifies data acquisition, reinforcement learning…

Artificial Intelligence · Computer Science 2024-10-15 Jun Wang , Meng Fang , Ziyu Wan , Muning Wen , Jiachen Zhu , Anjie Liu , Ziqin Gong , Yan Song , Lei Chen , Lionel M. Ni , Linyi Yang , Ying Wen , Weinan Zhang

The integration of Large Language Models (LLMs) with Retrieval-Augmented Generation (RAG) has significantly advanced Knowledge Graph Question Answering (KGQA). However, existing LLM-driven KGQA systems act as stateless planners, generating…

Databases · Computer Science 2026-04-30 Yushi Sun , Lei Chen

Combining large language models with logical reasoning enhances their capacity to address problems in a robust and reliable manner. Nevertheless, the intricate nature of logical reasoning poses challenges when gathering reliable data from…

Large language models (LLMs) have shown promising potential in scientific research, enabling tasks ranging from knowledge retrieval to property prediction. Existing science benchmarks mainly focus on perceptual or knowledge-based tasks,…

With the rapid advancement of tool-use capabilities in Large Language Models (LLMs), Retrieval-Augmented Generation (RAG) is shifting from static, one-shot retrieval toward autonomous, multi-turn evidence acquisition. However, existing…

Artificial Intelligence · Computer Science 2026-02-13 Zhanli Li , Huiwen Tian , Lvzhou Luo , Yixuan Cao , Ping Luo

Large Language Models (LLMs) demonstrate strong reasoning abilities but face limitations such as hallucinations and outdated knowledge. Knowledge Graph (KG)-based Retrieval-Augmented Generation (RAG) addresses these issues by grounding LLM…

Computation and Language · Computer Science 2025-03-04 Mufei Li , Siqi Miao , Pan Li

Composite commits, which entangle multiple unrelated concerns, are prevalent in software development and significantly hinder program comprehension and maintenance. Existing automated untangling methods, particularly state-of-the-art graph…

Software Engineering · Computer Science 2026-01-06 Kangchen Zhu , Zhiliang Tian , Shangwen Wang , Mingyue Leng , Xiaoguang Mao

This paper presents OG-RAG, an Ontology-Grounded Retrieval Augmented Generation method designed to enhance LLM-generated responses by anchoring retrieval processes in domain-specific ontologies. While LLMs are widely used for tasks like…

Computation and Language · Computer Science 2024-12-23 Kartik Sharma , Peeyush Kumar , Yunqing Li

Large Language Models (LLMs) and Knowledge Graphs (KGs) offer a promising approach to robust and explainable Question Answering (QA). While LLMs excel at natural language understanding, they suffer from knowledge gaps and hallucinations.…

Machine Learning · Computer Science 2025-04-15 Jasper Linders , Jakub M. Tomczak

Long-context reasoning is essential for complex real-world applications, yet remains a significant challenge for Large Language Models (LLMs). Despite the rapid evolution in long-context reasoning, current research often overlooks the…

Computation and Language · Computer Science 2026-04-10 Yanling Xiao , Huaibing Xie , Guoliang Zhao , Shihan Dou , Shaolei Wang , Yiting Liu , Nantao Zheng , Cheng Zhang , Pluto Zhou , Zhisong Zhang , Lemao Liu

Large Language Models (LLMs) have shown promising performance on diverse medical benchmarks, highlighting their potential in supporting real-world clinical tasks. Retrieval-Augmented Generation (RAG) has emerged as a key approach for…

Computation and Language · Computer Science 2025-09-30 Kaishuai Xu , Wenjun Hou , Yi Cheng , Wenjie Li

Large Language Models (LLMs) have succeeded remarkably in various natural language processing (NLP) tasks, yet their reasoning capabilities remain a fundamental challenge. While LLMs exhibit impressive fluency and factual recall, their…

Computation and Language · Computer Science 2025-05-29 Avinash Patil , Aryan Jadon

Academic question answering (QA) in heterogeneous scholarly networks presents unique challenges requiring both structural understanding and interpretable reasoning. While graph neural networks (GNNs) capture structured graph information and…

Social and Information Networks · Computer Science 2026-01-30 Runsong Jia , Mengjia Wu , Ying Ding , Jie Lu , Yi Zhang

LLMs have demonstrated remarkable capabilities in complex reasoning tasks, yet they often suffer from hallucinations and lack reliable factual grounding. Meanwhile, knowledge graphs (KGs) provide structured factual knowledge but lack the…

Computation and Language · Computer Science 2025-05-28 Xiangqing Shen , Fanfan Wang , Rui Xia

Multi-source multi-hop question answering (QA) represents a challenging task in natural language processing due to the need for dynamic integration of heterogeneous knowledge sources and multi-step reasoning. Existing methods often suffer…

Computation and Language · Computer Science 2025-02-11 Jackson Coleman , Isaiah Lawrence , Benjamin Turner

Large Language Models (LLMs) have demonstrated impressive performance in natural language processing tasks by leveraging chain of thought (CoT) that enables step-by-step thinking. Extending LLMs with multimodal capabilities is the recent…

Computation and Language · Computer Science 2024-01-24 Debjyoti Mondal , Suraj Modi , Subhadarshi Panda , Rituraj Singh , Godawari Sudhakar Rao

Large language models (LLMs), such as GPT3.5, GPT4 and LLAMA2 perform surprisingly well and outperform human experts on many tasks. However, in many domain-specific evaluations, these LLMs often suffer from hallucination problems due to…

Computation and Language · Computer Science 2024-04-19 Yuqi Wang , Boran Jiang , Yi Luo , Dawei He , Peng Cheng , Liangcai Gao

Retrieval-Augmented Generation (RAG) enhances the performance of Large Language Models (LLMs) by incorporating external knowledge. However, LLMs still encounter challenges in effectively utilizing the knowledge from retrieved documents,…

Computation and Language · Computer Science 2025-02-26 Mingyan Wu , Zhenghao Liu , Yukun Yan , Xinze Li , Shi Yu , Zheni Zeng , Yu Gu , Ge Yu
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