| Isoconversional kinetic analysis of ring-opening polymerization of ε-caprolactone: Steric influence of titanium(IV) alkoxides as initiators W Meelua, R Molloy, P Meepowpan, W Punyodom Journal of Polymer Research 19, 1-11, 2012 | 40 | 2012 |
| Theoretical studies on aluminum trialkoxide-initiated lactone ring-opening polymerizations: Roles of alkoxide substituent and monomer ring structure J Jitonnom, R Molloy, W Punyodom, W Meelua Computational and Theoretical Chemistry 1097, 25-32, 2016 | 31 | 2016 |
| Effect of ligand structure in the trimethylene carbonate polymerization by cationic zirconocene catalysts: A “naked model” DFT study J Jitonnom, W Meelua Journal of Organometallic Chemistry 841, 48-56, 2017 | 12 | 2017 |
| Cationic ring-opening polymerization of cyclic carbonates and lactones by group 4 metallocenes: A theoretical study on mechanism and ring-strain effects J Jitonnom, W Meelua Journal of Theoretical and Computational Chemistry 16 (01), 1750003, 2017 | 12 | 2017 |
| Comparison of metal alkoxide initiators in the ring-opening polymerization of caprolactone W Meelua, V Bua-Own, R Molloy, W Punyodom Advanced Materials Research 506, 142-145, 2012 | 12 | 2012 |
| Active site dynamics and catalytic mechanism in arabinan hydrolysis catalyzed by GH43 endo-arabinanase from QM/MM molecular dynamics simulation and potential energy surface W Meelua, T Wanjai, N Thinkumrob, J Oláh, JI Mujika, JR Ketudat-Cairns, ... Journal of Biomolecular Structure and Dynamics 40 (16), 7439-7449, 2022 | 9 | 2022 |
| DFT study of formation and properties of dinuclear zirconocene cations: Effects of ligand structure, solvent, and metal on the dimerization process W Meelua, N Keawkla, J Oláh, J Jitonnom Journal of Organometallic Chemistry 905, 121024, 2020 | 9 | 2020 |
| DFT study of lactide ring-opening polymerizations by aluminium trialkoxides: Understanding the effects of monomer, alkoxide substituent, solvent and metal J Jitonnom, W Meelua Chemical Physics Letters 750, 137482, 2020 | 8 | 2020 |
| Effects of silicon-bridge and π-ligands on the electronic structures and related properties of dimethyl zirconocene polymerization catalysts: A comparative theoretical study J Jitonnom, W Meelua Sci 41 (5.2), 1220-1229, 2014 | 8 | 2014 |
| The use of aluminum trialkoxide for synthesis of poly (ε-caprolactone) and poly (δ-valerolactone): A comparative study J Jitonnom, R Molloy, W Punyodom, W Meelua Songklanakarin J. Sci. Technol 40 (4), 854-859, 2018 | 6 | 2018 |
| Structural basis for inhibition of a GH116 β-glucosidase and its missense mutants by GBA2 inhibitors: Crystallographic and quantum chemical study W Meelua, N Thinkumrob, P Saparpakorn, S Pengthaisong, ... Chemico-Biological Interactions 384, 110717, 2023 | 5 | 2023 |
| Role of water coordination at zinc binding site and its catalytic pathway of dizinc creatininase: insights from quantum cluster approach W Meelua, J Oláh, J Jitonnom Journal of Computer-Aided Molecular Design 36 (4), 279-289, 2022 | 5 | 2022 |
| A computational study of the reaction mechanism and stereospecificity of dihydropyrimidinase W Meelua, T Wanjai, N Thinkumrob, J Oláh, JRK Cairns, S Hannongbua, ... Physical Chemistry Chemical Physics 25 (12), 8767-8778, 2023 | 3 | 2023 |
| Data on electronic structures for the study of ligand effects on the zirconocene-mediated trimethylene carbonate polymerization J Jitonnom, W Meelua Data in brief 20, 1867-1869, 2018 | 3 | 2018 |
| Mechanism of ring‐opening polymerization of l‐lactide by lanthanide aryloxide: A theoretical study on the effect of the aryloxide ligands on the process W Meelua, T Wanjai, T Chokbunpiam, J Jitonnom International Journal of Quantum Chemistry 123 (16), e27134, 2023 | 2 | 2023 |
| Multiscale QM/MM Simulations Identify the Roles of Asp239 and 1-OH···Nucleophile in Transition State Stabilization in Arabidopsis thaliana Cell-Wall Invertase 1 W Meelua, T Wanjai, N Thinkumrob, R Friedman, J Jitonnom Journal of Chemical Information and Modeling 63 (15), 4827-4838, 2023 | 2 | 2023 |
| Computational evaluation of zirconocene catalysts for ε-caprolactone cationic ring-opening polymerization W Meelua, T Wanjai, J Jitonnom Scientific Reports 14 (1), 3952, 2024 | 1 | 2024 |
| Kinetics and thermodynamics studies of the ring-opening polymerization of ε-caprolactone initiated by titanium (IV) alkoxides by isothermal differential scanning calorimetry W Limwanich, W Meelua, P Meepowpan, W Punyodom Reaction Kinetics, Mechanisms and Catalysis 135 (2), 881-895, 2022 | 1 | 2022 |
| DFT study of sucrose hydrolysis by a GH32 cell-wall invertase, a key enzyme in carbohydrate metabolism W Meelua, J Jitonnom Molecular Simulation 50 (4), 298-307, 2024 | | 2024 |
| Binding interactions and in silico ADME prediction of isoconessimine derivatives as potent acetylcholinesterase inhibitors P Tue-Ngeun, W Rakitikul, N Thinkumrob, S Hannongbua, W Meelua, ... Journal of Molecular Graphics and Modelling, 108746, 2024 | | 2024 |
