Loading...

Effect of Water Microsolvation on the Excited-State Proton Transfer of 3-Hydroxyflavone Enclosed in γ-Cyclodextrin

The effect of microsolvation on excited-state proton transfer (ESPT) reaction of 3-hydroxyflavone (3HF) and its inclusion complex with γ-cyclodextrin (γ-CD) was studied using computational approaches. From molecular dynamics simulations, two possible inclusion complexes formed by the chromone ring (...

Fuld beskrivelse

Na minha lista:
Bibliografiske detaljer
Udgivet i:Molecules
Main Authors: Kerdpol, Khanittha, Daengngern, Rathawat, Sattayanon, Chanchai, Namuangruk, Supawadee, Rungrotmongkol, Thanyada, Wolschann, Peter, Kungwan, Nawee, Hannongbua, Supot
Format: Artigo
Sprog:Inglês
Udgivet: MDPI 2021
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7914428/
https://ncbi.nlm.nih.gov/pubmed/33562757
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26040843
Tags: Tilføj Tag
Ingen Tags, Vær først til at tagge denne postø!