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Experimental and Molecular Mechanical Studies of Complexation of Some 2H- and 3H- Indole Derivatives with Aqueousβ-Cyclodextrin

✍ Scribed by Khaldoun A. Al-Sou’od; Mohammad B. Zughul; Adnan A. Badwan


Publisher
Springer US
Year
2006
Tongue
English
Weight
367 KB
Volume
35
Category
Article
ISSN
0095-9782

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✍ Jose Manuel Madrid; Javier Pozuelo; Francisco Mendicuti; Wayne L. Mattice 📂 Article 📅 1997 🏛 Elsevier Science 🌐 English ⚖ 308 KB

Molecular mechanics calculations were employed to study the inclusion of 2-methyl naphthoate in alpha- and beta-cyclodextrin in vacuo and in the presence of water as a solvent. The driving forces for complexation are dominated by nonbonded van der Waals host:guest interactions in both environments.