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Knowledge Graph for Solubility Big Data: Construction and Applications

Xiao Haiyang, Yan Ruomei, Wu Yan, Guan Lixin, Li Mengshan · WIREs Data Mining and Knowledge Discovery · 2024

ABSTRACTDissolution refers to the process in which solvent molecules and solute molecules attract and combine with each other. The extensive solubility data generated from the dissolution of various compounds under different conditions, is distributed across structured or semi‐structured formats in various media, such as text, web pages, tables, images, and databases. These data exhibit multi‐source and unstructured features, aligning with the typical 5 V characteristics of big data. A solubility big data technology system has emerged under the fusion of solubility data and big data technologies. However, the acquisition, fusion, storage, representation, and utilization of solubility big data are encountering new challenges. Knowledge Graphs, known as extensive systems for representing and applying knowledge, can effectively describe entities, concepts, and relations across diverse domains. The construction of solubility big data knowledge graph holds substantial value in the retrieval, analysis, utilization, and visualization of solubility knowledge. Throwing out a brick to attract a jade, this paper focuses on the solubility big data knowledge graph and, firstly, summarizes the a

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