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

by Khuntawee W., Rungrotmongkol T., Wolschann P., Pongsawasdi P., Kungwan N., Okumura H., Hannongbua S.
Published 2017

Comparison of Implicit and Explicit Solvation Models for Iota-Cyclodextrin Conformation Analysis from Replica Exchange Molecular Dynamics

by Khuntawee W., Kunaseth M., Rungnim C., Intagorn S., Wolschann P., Kungwan N., Rungrotmongkol T., Hannongbua S.
Published 2017

Inclusion complexation of pinostrobin with various cyclodextrin derivatives

by Kicuntod J., Khuntawee W., Wolschann P., Pongsawasdi P., Chavasiri W., Kungwan N., Rungrotmongkol T.
Published 2017

Binding mode and free energy prediction of fisetin/β-cyclodextrin inclusion complexes

by Nutho,B., Khuntawee,W., Rungnim,C., Pongsawasdi,P., Wolschann,P., Karpfen,A., Kungwan,N., Rungrotmongkol,T.
Published 2015