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Browsing by Author Nawee Kungwan
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Showing results 6 to 25 of 157
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Issue Date
Title
Author(s)
15-Jan-2019
Binding pattern and susceptibility of epigallocatechin gallate against envelope protein homodimer of Zika virus: A molecular dynamics study
Kowit Hengphasatporn
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
17-Jun-2015
Binding specificity of polypeptide substrates in NS2B/NS3pro serine protease of dengue virus type 2: A molecular dynamics Study
Pathumwadee Yotmanee
;
Thanyada Rungrotmongkol
;
Kanin Wichapong
;
Sy Bing Choi
;
Habibah A. Wahab
;
Nawee Kungwan
;
Supot Hannongbua
28-Feb-2016
Capability of defective graphene-supported Pd<inf>13</inf>and Ag<inf>13</inf>particles for mercury adsorption
Jittima Meeprasert
;
Anchalee Junkaew
;
Chompoonut Rungnim
;
Manaschai Kunaseth
;
Nawee Kungwan
;
Vinich Promarak
;
Supawadee Namuangruk
5-May-2018
Carbon-doped boron nitride nanosheet as a promising metal-free catalyst for NO reduction: DFT mechanistic study
Tanabat Mudchimo
;
Supawadee Namuangruk
;
Nawee Kungwan
;
Siriporn Jungsuttiwong
1-Jan-2018
Catalytic reduction mechanism of deoxygenation of NO via the CO-reaction pathway using nanoalloy Ag<inf>7</inf>Au<inf>6</inf>clusters: Density functional theory investigation
Yutthana Wongnongwa
;
Supawadee Namuangruk
;
Nawee Kungwan
;
Siriporn Jungsuttiwong
16-Jan-2019
Cavity closure of 2-hydroxypropyl-β-cyclodextrin: Replica exchange molecular dynamics simulations
Khanittha Kerdpol
;
Jintawee Kicuntod
;
Peter Wolschann
;
Seiji Mori
;
Chompoonut Rungnim
;
Manaschai Kunaseth
;
Hisashi Okumura
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
1-Jan-2017
Combined experimental and theoretical investigation on Fluorescence Resonance Energy Transfer of dye loaded on LTL zeolite
Wilaiporn Insuwan
;
Kunwadee Rangsriwatananon
;
Jittima Meeprasert
;
Supawadee Namuangruk
;
Yaowarat Surakhot
;
Nawee Kungwan
;
Siriporn Jungsuttiwong
1-Jan-2014
Combined experimental and theoretical investigation on photophysical properties of trans-azobenzene confined in LTL zeolite: Effect of cis-isomer forming
Wilaiporn Insuwan
;
Kunwadee Rangsriwatananon
;
Jittima Meeprasert
;
Supawadee Namuangruk
;
Yaowarat Surakhot
;
Nawee Kungwan
;
Siriporn Jungsuttiwong
24-Apr-2017
Comparison of Implicit and Explicit Solvation Models for Iota-Cyclodextrin Conformation Analysis from Replica Exchange Molecular Dynamics
Wasinee Khuntawee
;
Manaschai Kunaseth
;
Chompoonut Rungnim
;
Suradej Intagorn
;
Peter Wolschann
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
;
Supot Hannongbua
1-Jan-2017
The complete reaction mechanism of H<inf>2</inf>S desulfurization on an anatase TiO<inf>2</inf>(001) surface: A density functional theory investigation
Anchalee Junkaew
;
Phornphimon Maitarad
;
Raymundo Arróyave
;
Nawee Kungwan
;
Dengsong Zhang
;
Liyi Shi
;
Supawadee Namuangruk
5-Jun-2016
Complete reaction mechanisms of mercury oxidation on halogenated activated carbon
Chompoonut Rungnim
;
Vinich Promarak
;
Supa Hannongbua
;
Nawee Kungwan
;
Supawadee Namuangruk
1-Jan-2019
Computational screening of chalcones acting against topoisomerase IIα and their cytotoxicity towards cancer cell lines
Kanyani Sangpheak
;
Monika Mueller
;
Nitchakan Darai
;
Peter Wolschann
;
Chonticha Suwattanasophon
;
Ritbey Ruga
;
Warinthon Chavasiri
;
Supaporn Seetaha
;
Kiattawee Choowongkomon
;
Nawee Kungwan
;
Chompoonut Rungnim
;
Thanyada Rungrotmongkol
7-Dec-2017
Computational screening of fatty acid synthase inhibitors against thioesterase domain
Wanwisa Panman
;
Bodee Nutho
;
Supakarn Chamni
;
Supaporn Dokmaisrijan
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
5-May-2016
Conformation study of ε-cyclodextrin: Replica exchange molecular dynamics simulations
Wasinee Khuntawee
;
Thanyada Rungrotmongkol
;
Peter Wolschann
;
Piamsook Pongsawasdi
;
Nawee Kungwan
;
Hisashi Okumura
;
Supot Hannongbua
1-May-2019
Conjugated biopolymer-assisted the binding of polypropylene toward single-walled carbon nanotube: A molecular dynamics simulation
Wanwisa Panman
;
Panupong Mahalapbutr
;
Oraphan Saengsawang
;
Chompoonut Rungnim
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
;
Supot Hannongbua
2019
Conjugated Biopolymer-assisted the Binding of Polypropylene Toward Single-walled Carbon Nanotube: A Molecular Dynamics Simulation
Wanwisa Panman
;
Panupong Mahalapbutr
;
Oraphan Saengsawang
;
Chompoonut Rungnim
;
Nawee Kungwan
;
Thanyada Rungrotmongkol
;
Supot Hannongbua
1-Jan-2016
Coumarin-based donor–π–acceptor organic dyes for a dye-sensitized solar cell: photophysical properties and electron injection mechanism
Supawadee Namuangruk
;
Siriporn Jungsuttiwong
;
Nawee Kungwan
;
Vinich Promarak
;
Taweesak Sudyoadsuk
;
Bavornpon Jansang
;
Masahiro Ehara
1-Jan-2016
A Cr-phthalocyanine monolayer as a potential catalyst for NO reduction investigated by DFT calculations
Jittima Meeprasert
;
Anchalee Junkaew
;
Nawee Kungwan
;
Bavornpon Jansang
;
Supawadee Namuangruk
26-May-2022
Deep-blue high-efficiency triplet-triplet annihilation organic light-emitting diodes using hydroxyl-substituted tetraphenylimidazole-functionalized anthracene fluorescent emitters
Wan Li
;
Pongsakorn Chasing
;
Phattananawee Nalaoh
;
Thanyarat Chawanpunyawat
;
Nuttapong Chantanop
;
Chattarika Sukpattanacharoen
;
Nawee Kungwan
;
Praweena Wongkaew
;
Taweesak Sudyoadsuk
;
Vinich Promarak
30-Jan-2016
Density functional theory study of elemental mercury adsorption on boron doped graphene surface decorated by transition metals
Siriporn Jungsuttiwong
;
Yutthana Wongnongwa
;
Supawadee Namuangruk
;
Nawee Kungwan
;
Vinich Promarak
;
Manaschai Kunaseth