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Representation of the Structure—A Key Point of Building QSAR/QSPR Models for Ionic Liquids
The process of encoding the structure of chemicals by molecular descriptors is a crucial step in quantitative structure-activity/property relationships (QSAR/QSPR) modeling. Since ionic liquids (ILs) are disconnected structures, various ways of representing their structure are used in the QSAR studi...
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| Publié dans: | Materials (Basel) |
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| Auteurs principaux: | , , |
| Format: | Artigo |
| Langue: | Inglês |
| Publié: |
MDPI
2020
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| Sujets: | |
| Accès en ligne: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7321456/ https://ncbi.nlm.nih.gov/pubmed/32486309 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ma13112500 |
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