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Molecule generation and optimization is a fundamental task in chemical domain. The rapid development of intelligent tools, especially large language models (LLMs) with powerful knowledge reserves and interactive capabilities, has provided…

Machine Learning · Computer Science 2026-02-10 Haoran Liu , Zheni Zeng , Yukun Yan , Yuxuan Chen , Yunduo Xiao

Recommendation Systems have become integral to modern user experiences, but lack transparency in their decision-making processes. Existing explainable recommendation methods are hindered by reliance on a post-hoc paradigm, wherein…

Information Retrieval · Computer Science 2024-12-04 Xiaohan Yu , Li Zhang , Chong Chen

Recent advancements have showcased the potential of Large Language Models (LLMs) in executing reasoning tasks, particularly facilitated by Chain-of-Thought (CoT) prompting. While tasks like arithmetic reasoning involve clear, definitive…

Information Retrieval · Computer Science 2024-08-05 Alicia Y. Tsai , Adam Kraft , Long Jin , Chenwei Cai , Anahita Hosseini , Taibai Xu , Zemin Zhang , Lichan Hong , Ed H. Chi , Xinyang Yi

Tool-augmented large language models (LLMs) leverage tools, often in the form of APIs, to improve their reasoning capabilities on complex tasks. This enables them to act as intelligent agents interacting with the real world. The recently…

Computation and Language · Computer Science 2025-03-24 Sijia Chen , Yibo Wang , Yi-Feng Wu , Qing-Guo Chen , Zhao Xu , Weihua Luo , Kaifu Zhang , Lijun Zhang

Effective code generation with language models hinges on two critical factors: accurately understanding the intent of the prompt and generating code that applies algorithmic reasoning to produce correct solutions capable of passing diverse…

Artificial Intelligence · Computer Science 2025-10-21 Amir Jalilifard , Anderson de Rezende Rocha , Marcos Medeiros Raimundo

State-of-the-art performance in QA tasks is currently achieved by systems employing Large Language Models (LLMs), however these models tend to hallucinate information in their responses. One approach focuses on enhancing the generation…

Computation and Language · Computer Science 2024-11-28 Moshe Berchansky , Daniel Fleischer , Moshe Wasserblat , Peter Izsak

ChatGPT said: Text-attributed graphs, where nodes and edges contain rich textual information, are widely used across diverse domains. A central challenge in this setting is question answering, which requires jointly leveraging unstructured…

Computation and Language · Computer Science 2025-12-23 Lihui Liu

Integrating free-text explanations to in-context learning of large language models (LLM) is shown to elicit strong reasoning capabilities along with reasonable explanations. In this paper, we consider the problem of leveraging the…

Computation and Language · Computer Science 2022-10-14 Shiyang Li , Jianshu Chen , Yelong Shen , Zhiyu Chen , Xinlu Zhang , Zekun Li , Hong Wang , Jing Qian , Baolin Peng , Yi Mao , Wenhu Chen , Xifeng Yan

Label distribution learning (LDL) is a general learning framework, which assigns to an instance a distribution over a set of labels rather than a single label or multiple labels. Current LDL methods have either restricted assumptions on the…

Machine Learning · Computer Science 2017-10-18 Wei Shen , Kai Zhao , Yilu Guo , Alan Yuille

Large models have demonstrated significant progress across various domains, particularly in tasks related to text generation. In the domain of Table to Text, many Large Language Model (LLM)-based methods currently resort to modifying…

Computation and Language · Computer Science 2024-04-30 Junyi Bian , Xiaolei Qin , Wuhe Zou , Mengzuo Huang , Congyi Luo , Ke Zhang , Weidong Zhang

This paper presents a hybrid architecture for intelligent systems in which large language models (LLMs) are extended with an external ontological memory layer. Instead of relying solely on parametric knowledge and vector-based retrieval…

Artificial Intelligence · Computer Science 2026-04-23 Pavel Salovskii , Iuliia Gorshkova

Transforming unstructured text into structured data is a complex task, requiring semantic understanding, reasoning, and structural comprehension. While Large Language Models (LLMs) offer potential, they often struggle with handling…

Computation and Language · Computer Science 2025-08-13 Rajmohan C , Sarthak Harne , Arvind Agarwal

Traditionally, AI development for two-player zero-sum games has relied on two primary techniques: decision trees and reinforcement learning (RL). A common approach involves using a fixed decision tree as one player's strategy while training…

Artificial Intelligence · Computer Science 2024-12-18 Junjie Lin , Jian Zhao , Lin Liu , Yue Deng , Youpeng Zhao , Lanxiao Huang , Xia Lin , Wengang Zhou , Houqiang Li

Large language models (LLMs) are increasingly used for high-stakes decision-making, yet existing approaches struggle to reconcile scalability, interpretability, and reproducibility. Black-box models obscure their reasoning, while recent…

Open-source Large Language models (OsLLMs) propel the democratization of natural language research by giving the flexibility to augment or update model parameters for performance improvement. Nevertheless, like proprietary LLMs, Os-LLMs…

Computation and Language · Computer Science 2024-12-16 Arijit Nag , Soumen Chakrabarti , Animesh Mukherjee , Niloy Ganguly

While large language models (LLMs) have demonstrated remarkable reasoning capabilities, they often struggle with complex tasks that require specific thinking paradigms, such as divide-and-conquer and procedural deduction, \etc Previous…

Software Engineering · Computer Science 2025-06-05 Kechi Zhang , Ge Li , Jia Li , Huangzhao Zhang , Jingjing Xu , Hao Zhu , Lecheng Wang , Jia Li , Yihong Dong , Jing Mai , Bin Gu , Zhi Jin

Recommendation systems aim to provide users with relevant suggestions, but often lack interpretability and fail to capture higher-level semantic relationships between user behaviors and profiles. In this paper, we propose a novel approach…

Information Retrieval · Computer Science 2024-01-26 Yan Wang , Zhixuan Chu , Xin Ouyang , Simeng Wang , Hongyan Hao , Yue Shen , Jinjie Gu , Siqiao Xue , James Y Zhang , Qing Cui , Longfei Li , Jun Zhou , Sheng Li

Causality is essential for understanding complex systems, such as the economy, the brain, and the climate. Constructing causal graphs often relies on either data-driven or expert-driven approaches, both fraught with challenges. The former…

Artificial Intelligence · Computer Science 2024-06-12 Kai-Hendrik Cohrs , Gherardo Varando , Emiliano Diaz , Vasileios Sitokonstantinou , Gustau Camps-Valls

Semantic reasoning aims to infer new knowledge from existing knowledge, with OWL ontologies serving as a standardized framework for organizing information. A key challenge in semantic reasoning is verifying ontology consistency. However,…

Artificial Intelligence · Computer Science 2025-04-29 Justin Mücke , Ansgar Scherp

Tabular data, a fundamental data format in machine learning, is predominantly utilized in competitions and real-world applications. The performance of tabular models--such as gradient boosted decision trees and neural networks--can vary…

Machine Learning · Computer Science 2025-05-20 Si-Yang Liu , Qile Zhou , Han-Jia Ye