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Computer-aided molecular design of solvents for accelerated reaction kinetics

✍ Scribed by Struebing, Heiko; Ganase, Zara; Karamertzanis, Panagiotis G.; Siougkrou, Eirini; Haycock, Peter; Piccione, Patrick M.; Armstrong, Alan; Galindo, Amparo; Adjiman, Claire S.


Book ID
121231205
Publisher
Nature Publishing Group
Year
2013
Tongue
English
Weight
820 KB
Volume
5
Category
Article
ISSN
1755-4330

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Computer Aided Molecular Design of Solve
✍ X. Yang; H. Song πŸ“‚ Article πŸ“… 2006 πŸ› John Wiley and Sons 🌐 English βš– 130 KB πŸ‘ 2 views

## Abstract A new algorithm, the classified enumeration, is proposed to solve computer aided molecular design of solvents for separation processes. In this method, all groups are sorted into two parts, skeleton groups and function groups. The former can constitute alkane, arene (aromatic hydrocarbo