## Abstract Complexation equilibria and kinetics of exchange of chloroform and dichloromethane molecules between the cavity of cryptophane‐E and bulk solution were investigated using NMR methods. Using one‐dimensional magnetization transfer (1D‐EXSY type sequence), chemical exchange rates were meas
✦ LIBER ✦
NMR studies of chloroform@cryptophane-A and chloroform@bis-cryptophane inclusion complexes oriented in thermotropic liquid crystals
✍ Scribed by Kathleen E. Chaffee; Malgorzata Marjanska; Boyd M. Goodson
- Book ID
- 108275598
- Publisher
- Elsevier Science
- Year
- 2006
- Tongue
- English
- Weight
- 557 KB
- Volume
- 29
- Category
- Article
- ISSN
- 0926-2040
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Quantitative assessment of the ''best fit'' between neutral molecules and the cavity of a ''rigid'' neutral receptor is a challenging task in supramolecular chemistry, drug design, and biology. We investigate this question by molecular dynamics and free-energy perturbation simulations . Ž . performe