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相关论文: Multimodal Search in Chemical Documents and Reacti…

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Existing chemical understanding tasks primarily rely on static molecular representations, limiting their ability to model inherently dynamic phenomena such as bond breaking or conformational changes, which are essential for a chemist to…

机器学习 · 计算机科学 2026-03-13 Xinyu Li , Zhen Zhang , Qi Chen , Anton van den Hengel , Lina Yao , Javen Qinfeng Shi

The ability to understand and answer questions over documents can be useful in many business and practical applications. However, documents often contain lengthy and diverse multimodal contents such as texts, figures, and tables, which are…

The Bond Graph approach and the Chemical Reaction Network approach to modelling biomolecular systems developed independently. This paper brings together the two approaches by providing a bond graph interpretation of the chemical reaction…

分子网络 · 定量生物学 2019-07-04 Peter J. Gawthrop , Edmund J. Crampin

Keyword-based searches are today's standard in digital libraries. Yet, complex retrieval scenarios like in scientific knowledge bases, need more sophisticated access paths. Although each document somewhat contributes to a domain's body of…

信息检索 · 计算机科学 2024-12-23 Hermann Kroll , Pascal Sackhoff , Timo Breuer , Ralf Schenkel , Wolf-Tilo Balke

Machine learning models are poised to make a transformative impact on chemical sciences by dramatically accelerating computational algorithms and amplifying insights available from computational chemistry methods. However, achieving this…

Natural language is expected to be a key medium for various human-machine interactions in the era of large language models. When it comes to the biochemistry field, a series of tasks around molecules (e.g., property prediction, molecule…

计算与语言 · 计算机科学 2023-06-22 Zheni Zeng , Bangchen Yin , Shipeng Wang , Jiarui Liu , Cheng Yang , Haishen Yao , Xingzhi Sun , Maosong Sun , Guotong Xie , Zhiyuan Liu

Recent research has taken advantage of Wikipedia's multilingualism as a resource for cross-language information retrieval and machine translation, as well as proposed techniques for enriching its cross-language structure. The availability…

数据库 · 计算机科学 2011-11-01 Thanh Nguyen , Viviane Moreira , Huong Nguyen , Hoa Nguyen , Juliana Freire

This paper challenges a cross-genre document retrieval task, where the queries are in formal writing and the target documents are in conversational writing. In this task, a query, is a sentence extracted from either a summary or a plot of…

计算与语言 · 计算机科学 2017-07-17 Tomasz Jurczyk , Jinho D. Choi

Biomedical research results are being published at a high rate, and with existing search engines, the vast amount of published work is usually easily accessible. However, reproducing published results, either experimental data or…

分子网络 · 定量生物学 2017-06-19 Kai-Wen Liang , Qinsi Wang , Cheryl Telmer , Divyaa Ravichandran , Peter Spirtes , Natasa Miskov-Zivanov

The task of retrieving video content relevant to natural language queries plays a critical role in effectively handling internet-scale datasets. Most of the existing methods for this caption-to-video retrieval problem do not fully exploit…

计算机视觉与模式识别 · 计算机科学 2020-07-22 Valentin Gabeur , Chen Sun , Karteek Alahari , Cordelia Schmid

The goal of this paper is to gather and develop some necessary and sufficient criteria for injectivity and multistationarity in vector fields associated with a chemical reaction network under a variety of more or less general assumptions on…

动力系统 · 数学 2016-10-28 Murad Banaji , Casian Pantea

The automatic analysis of chemical literature has immense potential to accelerate the discovery of new materials and drugs. Much of the critical information in patent documents and scientific articles is contained in figures, depicting the…

计算机视觉与模式识别 · 计算机科学 2024-08-29 Lucas Morin , Martin Danelljan , Maria Isabel Agea , Ahmed Nassar , Valery Weber , Ingmar Meijer , Peter Staar , Fisher Yu

Processes involving multi-input multi-step reaction cascades are used in developing novel biosensing, biocomputing, and decision making systems. In various applications different changes in responses of the constituent processing steps…

分子网络 · 定量生物学 2016-08-16 Sergii Domanskyi , Vladimir Privman

The ability to reason beyond established knowledge allows Organic Chemists to solve synthetic problems and to invent novel transformations. Here, we propose a model which mimics chemical reasoning and formalises reaction prediction as…

人工智能 · 计算机科学 2017-12-27 Marwin H. S. Segler , Mark P. Waller

With the rapid advancement of multimodal retrieval and its application in LLMs and multimodal LLMs, increasingly complex retrieval tasks have emerged. Existing methods predominantly rely on task-specific fine-tuning of vision-language…

计算机视觉与模式识别 · 计算机科学 2025-09-12 Davide Caffagni , Sara Sarto , Marcella Cornia , Lorenzo Baraldi , Rita Cucchiara

Designing powerful tools that support cooking activities has rapidly gained popularity due to the massive amounts of available data, as well as recent advances in machine learning that are capable of analyzing them. In this paper, we…

计算与语言 · 计算机科学 2018-05-01 Micael Carvalho , Rémi Cadène , David Picard , Laure Soulier , Nicolas Thome , Matthieu Cord

The exploration of multimodal language models integrates multiple data types, such as images, text, language, audio, and other heterogeneity. While the latest large language models excel in text-based tasks, they often struggle to…

人工智能 · 计算机科学 2023-11-23 Jiayang Wu , Wensheng Gan , Zefeng Chen , Shicheng Wan , Philip S. Yu

In the field of Material Science, effective information retrieval systems are essential for facilitating research. Traditional Retrieval-Augmented Generation (RAG) approaches in Large Language Models (LLMs) often encounter challenges such…

信息检索 · 计算机科学 2024-12-03 Radeen Mostafa , Mirza Nihal Baig , Mashaekh Tausif Ehsan , Jakir Hasan

This work deals with the challenge of learning and reasoning over multi-modal multi-hop question answering (QA). We propose a graph reasoning network based on the semantic structure of the sentences to learn multi-source reasoning paths and…

计算与语言 · 计算机科学 2025-01-09 Navya Yarrabelly , Saloni Mittal

Semantic retrieval, which retrieves semantically matched items given a textual query, has been an essential component to enhance system effectiveness in e-commerce search. In this paper, we study the multimodal retrieval problem, where the…

信息检索 · 计算机科学 2025-06-26 Zhigong Zhou , Ning Ding , Xiaochuan Fan , Yue Shang , Yiming Qiu , Jingwei Zhuo , Zhiwei Ge , Songlin Wang , Lin Liu , Sulong Xu , Han Zhang