Cooperative threading of asymmetric rings onto a linear chain

Authors
Citation
J. Horsky, Cooperative threading of asymmetric rings onto a linear chain, MACROMOL TH, 9(9), 2000, pp. 759-771
Citations number
16
Categorie Soggetti
Organic Chemistry/Polymer Science
Journal title
MACROMOLECULAR THEORY AND SIMULATIONS
ISSN journal
10221344 → ACNP
Volume
9
Issue
9
Year of publication
2000
Pages
759 - 771
Database
ISI
SICI code
1022-1344(200012)9:9<759:CTOARO>2.0.ZU;2-E
Abstract
The hopping model of pseudopolyrotaxane formation by threading of rings ont o a linear chain was modified to allow for cooperative interactions between adjacent rings and their asymmetry. In equilibrium, pseudopolyrotaxane for mation may be treated as binding to a one-dimensional array of fully access ible sites. If the time evolution of threading is sought the transport thro ugh connected sites has to be considered, and the problem can be solved num erically using stochastic simulation. The application of the model to threa ding of cyclodextrins onto polymeric chains shows that completely regular h ead-to-head/tail-to-tail arrangement cannot be expected.