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Browsing by Author Anan Tongraar

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Showing results 4 to 11 of 11 < previous 
Issue DateTitleAuthor(s)
7-Dec-2011Hydration structure and dynamics of K<sup>+</sup>and Ca<sup>2+</sup>in aqueous solution: Comparison of conventional QM/MM and ONIOM-XS MD simulationsSupachai Wanprakhon; Anan Tongraar; Teerakiat Kerdcharoen; Suranaree University of Technology; Mahidol University
1-Oct-2012Insights into the structure and dynamics of liquid water: A comparative study of conventional QM/MM and ONIOM-XS MD simulationsSukhontip Thaomola; Anan Tongraar; Teerakiat Kerdcharoen; Suranaree University of Technology; Mahidol University
13-Jan-2015Preferential solvation and dynamics of Li<sup>+</sup>in aqueous ammonia solution: An ONIOM-XS MD simulation studyPilailuk Kabbalee; Anan Tongraar; Teerakiat Kerdcharoen; Suranaree University of Technology; Mahidol University
13-Apr-2006Simulations of liquid ammonia based on the combined Quantum Mechanical/Molecular Mechanical (QM/MM) approachAnan Tongraar; Teerakiat Kerdcharoen; Supot Hannongbua; Suranaree University of Technology; Mahidol University; Chulalongkorn University
1-Jan-2015Solvation structure and dynamics of K<sup>+</sup>in aqueous ammonia solution: Insights from an ONIOM-XS MD simulationPilailuk Kabbalee; Pattrawan Sripa; Anan Tongraar; Teerakiat Kerdcharoen; Suranaree University of Technology; Mahidol University
16-Dec-2015Solvation structure and dynamics of Na<sup>+</sup> in liquid ammonia studied by ONIOM-XS MD simulationsJarukorn Sripradite; Anan Tongraar; Teerakiat Kerdcharoen; Suranaree University of Technology; Mahidol University
1-Aug-2015Structure and dynamics of the Li&lt;sup&gt;+&lt;/sup&gt; hydrates: A comparative study of conventional QM/MM and ONIOM-XS MD simulationsPattrawan Sripa; Anan Tongraar; Teerakiat Kerdcharoen; Suranaree University of Technology; NANOTECH-SUT Center of Excellence on Advanced Functional Nanomaterials; Mahidol University
11-Mar-2013"Structure-making" ability of Na<sup>+</sup>in dilute aqueous solution: An ONIOM-XS MD simulation studyPattrawan Sripa; Anan Tongraar; Teerakiat Kerdcharoen; Suranaree University of Technology; Mahidol University