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The influence of solid state information and descriptor selection on statistical models of temperature dependent aqueous solubility
Predicting the equilibrium solubility of organic, crystalline materials at all relevant temperatures is crucial to the digital design of manufacturing unit operations in the chemical industries. The work reported in our current publication builds upon the limited number of recently published quantit...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer International Publishing
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6115327/ https://www.ncbi.nlm.nih.gov/pubmed/30159699 http://dx.doi.org/10.1186/s13321-018-0298-3 |