Conformation study of ε-cyclodextrin: Replica exchange molecular dynamics simulations

© 2015 Elsevier Ltd. All rights reserved. There is growing interest in large-ring cyclodextrins (LR-CDs) which are known to be good host molecules for larger ligands. The isolation of a defined size LR-CD is an essential prerequisite for studying their structural properties. Unfortunately the purifi...

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Bibliographic Details
Main Authors: Wasinee Khuntawee, Thanyada Rungrotmongkol, Peter Wolschann, Piamsook Pongsawasdi, Nawee Kungwan, Hisashi Okumura, Supot Hannongbua
Format: Journal
Published: 2018
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Online Access:https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=84954047145&origin=inward
http://cmuir.cmu.ac.th/jspui/handle/6653943832/55458
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Institution: Chiang Mai University