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Computer aided molecular design: a novel method for optimal solvent selection

โœ Scribed by O. Odele; S. Macchietto


Book ID
107995741
Publisher
Elsevier Science
Year
1993
Tongue
English
Weight
570 KB
Volume
82
Category
Article
ISSN
0378-3812

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## 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