Definition. Given a set of chemical compounds, chemical data mining is to characterize the compounds present in the data set and apply a variety of mining methods to discover relationships between the compounds and their biological and chemical activities.
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Feb 13, 2024 · In addition, we demonstrated successful data mining with the web-based learning platform I3Learn. Integrating learning analytics in chemistry ...
Mar 11, 2019 · In recent years, data-mining has been widely applied for solving problems in chemical, materials, and engineering processes, based on the data ...
Mar 27, 2023 · This work aims to present an automated, interpretable impurity prediction workflow based on data mining large chemical reaction databases.
Apr 26, 2022 · Data mining and knowledge discovery (DMKD) can be a powerful tool in the analysis of chemical plant data. However, method selection and implementation can be a ...
Chemistry is well suited to quantitative studies of its history. ... Data mining the archives. By Philip Ball20 February 2024.
Nov 2, 2022 · Big (Bio)Chemical Data Mining Using Chemometric Methods: A Need for Chemists ... In this Review, the importance of "big data" and of their ...
Data Mining and Machine Learning Models for Predicting Drug ...
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Data mining approaches can uncover underlying patterns in chemical and pharmacological property space decisive for drug discovery and development.
With the rapid development of machine learning techniques, data-mining for processes in chemistry, materials, and engineering has been widely reported in ...