Coarse-grained molecular dynamics simulations of immobilized micelle systems and their interactions with hydrophobic molecules

Author(s)
Gokhale, Devashish; Chen, Ian; Doyle, Patrick S
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Creative Commons Attribution NonCommercial License 3.0 https://creativecommons.org/licenses/by-nc/3.0/
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Abstract
<jats:p>Coarse-grained molecular dynamics simulations of immobilized micelles show that immobilizing constraints can strengthen micelle–small molecule interactions with important implications for drug delivery, water treatment and other applications.</jats:p>
Date issued
2022-06-22
URI
https://hdl.handle.net/1721.1/144403
Department
Massachusetts Institute of Technology. Department of Chemical Engineering; Massachusetts Institute of Technology. Department of Materials Science and Engineering
Journal
Soft Matter
Publisher
Royal Society of Chemistry (RSC)
Citation
Gokhale, Devashish, Chen, Ian and Doyle, Patrick S. 2022. "Coarse-grained molecular dynamics simulations of immobilized micelle systems and their interactions with hydrophobic molecules." Soft Matter, 18 (24).
Version: Final published version
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