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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Detalles Bibliográficos
Autores principales: Rybińska-Fryca, Anna, Sosnowska, Anita, Puzyn, Tomasz
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7321456/
https://www.ncbi.nlm.nih.gov/pubmed/32486309
http://dx.doi.org/10.3390/ma13112500

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7321456/
https://www.ncbi.nlm.nih.gov/pubmed/32486309
http://dx.doi.org/10.3390/ma13112500

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