cheminformatics

synonym: chemoinformatics
https://doi.org/10.1351/goldbook.11421

The science of handling, indexing, archiving, searching, and evaluating information that is specific to chemical structures and is used in data mining, information retrieval, information extraction, and machine learning.

Source:
PAC, 2016, 88, 239. (Glossary of terms used in computational drug design, part II (IUPAC Recommendations 2015)) on page 243 [Terms] [Paper]
Citation: 'cheminformatics' in IUPAC Compendium of Chemical Terminology, 5th ed. International Union of Pure and Applied Chemistry; 2025. Online version 5.0.0, 2025. https://doi.org/10.1351/goldbook.11421 RIS BibTex EndNote
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