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A predictive PC-SAFT EOS based on COSMO for pharmaceutical compounds

The present study was conducted to develop a predictive type of PC-SAFT EOS by incorporating the COSMO computations. With the proposed model, the physical adjustable inputs to PC-SAFT EOS were determined from the suggested correlations with dependency to COSMO computation results. Afterwards, we tes...

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Vydáno v:Sci Rep
Hlavní autoři: Mahmoudabadi, Samane Zarei, Pazuki, Gholamreza
Médium: Artigo
Jazyk:Inglês
Vydáno: Nature Publishing Group UK 2021
Témata:
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC7979706/
https://ncbi.nlm.nih.gov/pubmed/33742065
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-021-85942-8
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