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JKCS

Journal of the Korean Chemical Society
Bimonthly Online Journal (eISSN: 2234-8530)

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Search : "[ keyword: Molecular dynamics ]" (4)
MD Simulation Study for Preferred Structure of Glycerol Backbone in 1,2-dioleoylsn-glycero-3-phosphocholine (DOPC) Molecule According to Solvent Properties
Ji yun Yang  Eugene Huh  Ik sung Ahn  Byung jin Mhin
Vol. 65, No. 3, pp. 179-184, Jun. 2021
10.5012/jkcs.2021.65.3.179
    분자동역학 인지질 유전상수 표면장력 글리세롤 골격구조 ,  Molecular dynamics Phospholipid Dielectric constant Surface tension Glycerol backbone
ReaxFF and Density Functional Theory Studies of Structural and Electronic Properties of Copper Oxide Clusters
Joo Hyeon Baek  Gyun Tack Bae
Vol. 64, No. 2, pp. 61-66, Apr. 2020
10.5012/jkcs.2020.64.2.61
    Copper oxide clusters Density functional theory Particulate Matter ReaxFF Molecular dynamics
Size Effect on Transport Properties of Liquid Argon: A Molecular Dynamics Simulation Study
Song Hi Lee
Vol. 58, No. 5, pp. 500-503, Oct. 2014
10.5012/jkcs.2014.58.5.500
    Molecular dynamics simulation Liquid argon Green-Kubo formula Transport properties
The Radial Distribution Functions of the Scaled OSS2 Water
Song Hi Lee
Vol. 56, No. 6, pp. 669-672, Dec. 2012
10.5012/jkcs.2012.56.6.669
    Molecular dynamics simulation Scaled OSS2 potential Radial distribution function

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    DFT Synthesis Antimicrobial activity Critical micelle concentration Adsorption Crystal structure Corrosion Schiff base Density functional theory

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ISSN(Print) 1017-2548
ISSN(Online) 2234-8530



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