1. CMU Intellectual Repository

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Results 61-70 of 156 (Search time: 0.005 seconds).
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Issue DateTitleAuthor(s)
1-Jan-2016Kinetics studies of non-isothermal melt crystallization of poly(ε-caprolactone) and poly(L-lactide)Wanich Limwanich; Sawarot Phetsuk; Puttinan Meepowpan; Nawee Kungwan; Winita Punyodom
11-Jun-2017Screening of hepatitis C NS5B polymerase inhibitors containing benzothiadiazine core: a steered molecular dynamicsBodee Nutho; Arthitaya Meeprasert; Methat Chulapa; Nawee Kungwan; Thanyada Rungrotmongkol
1-Jan-2017Metadynamics supports molecular dynamics simulation-based binding affinities of eucalyptol and beta-cyclodextrin inclusion complexesBodee Nutho; Nadtanet Nunthaboot; Peter Wolschann; Nawee Kungwan; Thanyada Rungrotmongkol
1-Jan-2017Push-Pull N-Annulated Perylene-Based Sensitizers for Dye-Sensitized Solar Cells: Theoretical Property Tuning by DFT/TDDFTSarinya Hadsadee; Rattanawalee Rattanawan; Ruangchai Tarsang; Nawee Kungwan; Siriporn Jungsuttiwong
1-Jan-2017Mechanistic study of NO oxidation on Cr-phthalocyanine: theoretical insightAnchalee Junkaew; Jittima Meeprasert; Bavornpon Jansang; Nawee Kungwan; Supawadee Namuangruk
1-Jan-2017Solvent dependence of double proton transfer in the formic acid-formamidine complex: Path integral molecular dynamics investigationNawee Kungwan; Chanisorn Ngaojampa; Yudai Ogata; Tsutomu Kawatsu; Yuki Oba; Yukio Kawashima; Masanori Tachikawa
22-Sep-2015Excited-state proton-transfer reactions of 7-azaindole with water, ammonia and mixed water-ammonia: Microsolvated dynamics simulationKhanittha Kerdpol; Rathawat Daengngern; Nawee Kungwan
1-Jun-2015Effects of alkoxide alteration on the ring-opening polymerization of ε-caprolactone initiated by n-Bu<inf>3</inf>SnOR: A DFT studyChanchai Sattayanon; Watit Sontising; Wanich Limwanich; Puttinan Meepowpan; Winita Punyodom; Nawee Kungwan
10-Jul-2015Electronic and photophysical properties of 2-(2′-hydroxyphenyl)benzoxazole and its derivatives enhancing in the excited-state intramolecular proton transfer processes: A TD-DFT study on substitution effectRathawat Daengngern; Nawee Kungwan
10-Jan-2015Effect of tributyltin alkoxides chain length on the ring-opening polymerization of ε-caprolactone: Kinetics studies by non-isothermal DSCWanich Limwanich; Sureerat Khunmanee; Nawee Kungwan; Winita Punyodom; Puttinan Meepowpan

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