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Results 11-19 of 19 (Search time: 0.004 seconds).
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Issue DateTitleAuthor(s)
24-Apr-2017Comparison of Implicit and Explicit Solvation Models for Iota-Cyclodextrin Conformation Analysis from Replica Exchange Molecular DynamicsWasinee Khuntawee; Manaschai Kunaseth; Chompoonut Rungnim; Suradej Intagorn; Peter Wolschann; Nawee Kungwan; Thanyada Rungrotmongkol; Supot Hannongbua
1-Jan-2018Glycan binding and specificity of viral influenza neuraminidases by classical molecular dynamics and replica exchange molecular dynamics simulationsJiraphorn Phanich; Siraphob Threeracheep; Nawee Kungwan; Thanyada Rungrotmongkol; Supot Hannongbua
1-May-2019Conjugated biopolymer-assisted the binding of polypropylene toward single-walled carbon nanotube: A molecular dynamics simulationWanwisa Panman; Panupong Mahalapbutr; Oraphan Saengsawang; Chompoonut Rungnim; Nawee Kungwan; Thanyada Rungrotmongkol; Supot Hannongbua
1-Dec-2019Atomistic mechanisms underlying the activation of the G protein-coupled sweet receptor heterodimer by sugar alcohol recognitionPanupong Mahalapbutr; Nitchakan Darai; Wanwisa Panman; Aunchan Opasmahakul; Nawee Kungwan; Supot Hannongbua; Thanyada Rungrotmongkol
1-Dec-2019Interactions of HLA-DR and Topoisomerase I Epitope Modulated Genetic Risk for Systemic SclerosisSirilak Kongkaew; Thanyada Rungrotmongkol; Chutintorn Punwong; Hiroshi Noguchi; Fujio Takeuchi; Nawee Kungwan; Peter Wolschann; Supot Hannongbua
15-Aug-2019Encapsulation of alpha-mangostin and hydrophilic beta-cyclodextrins revealed by all-atom molecular dynamics simulationsWiparat Hotarat; Sarunya Phunpee; Chompoonut Rungnim; Peter Wolschann; Nawee Kungwan; Uracha Ruktanonchai; Thanyada Rungrotmongkol; Supot Hannongbua
2019Conjugated Biopolymer-assisted the Binding of Polypropylene Toward Single-walled Carbon Nanotube: A Molecular Dynamics SimulationWanwisa Panman; Panupong Mahalapbutr; Oraphan Saengsawang; Chompoonut Rungnim; Nawee Kungwan; Thanyada Rungrotmongkol; Supot Hannongbua
1-Dec-2019Publisher Correction: Atomistic mechanisms underlying the activation of the G protein-coupled sweet receptor heterodimer by sugar alcohol recognition (Scientific Reports, (2019), 9, 1, (10205), 10.1038/s41598-019-46668-w)Panupong Mahalapbutr; Nitchakan Darai; Wanwisa Panman; Aunchan Opasmahakul; Nawee Kungwan; Supot Hannongbua; Thanyada Rungrotmongkol
2-Feb-2021Effect of water microsolvation on the excited-state proton transfer of 3-hydroxyflavone enclosed in -cyclodextrinKhanittha Kerdpol; Rathawat Daengngern; Chanchai Sattayanon; Supawadee Namuangruk; Thanyada Rungrotmongkol; Peter Wolschann; Nawee Kungwan; Supot Hannongbua

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