Metadynamics supports molecular dynamics simulation-based binding affinities of eucalyptol and beta-cyclodextrin inclusion complexes

Metadynamics supports molecular dynamics simulation-based binding affinities of eucalyptol and beta-cyclodextrin inclusion complexes

© The Royal Society of Chemistry. The development of various molecular dynamics methods enables the detailed investigation of association processes, like host-guest complexes, including their dynamics and, additionally, the release of the guest compound. As an example of the application of such meth...

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書目詳細資料
Main Authors:	Bodee Nutho, Nadtanet Nunthaboot, Peter Wolschann, Nawee Kungwan, Thanyada Rungrotmongkol
格式:	雜誌
出版:	2018
主題:	Chemical Engineering Chemistry
在線閱讀:	https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=85032972173&origin=inward http://cmuir.cmu.ac.th/jspui/handle/6653943832/56946
標簽:	添加標簽沒有標簽, 成為第一個標記此記錄!
機構:	Chiang Mai University

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