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Kim, Woo Youn (김우연)
부교수, Department of Chemistry(화학과)
Research Area
Nano, Physical, Theoretical
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    NO Title, Author(s) (Publication Title, Volume Issue, Page, Issue Date) Altmetrics
    1
    Article
    A Bayesian graph convolutional network for reliable prediction of molecular properties with uncertainty quantification

    Ryu, Seongok; Kwon, Yongchan; Kim, Woo Younresearcher, CHEMICAL SCIENCE, v.10, no.36, pp.8438 - 8446, 2019-09

    2
    Article
    Predicting Drug-Target Interaction Using a Novel Graph Neural Network with 3D Structure-Embedded Graph Representation

    Lim, Jaechang; Ryu, Seongok; Park, Kyubyong; et al, JOURNAL OF CHEMICAL INFORMATION AND MODELING, v.59, no.9, pp.3981 - 3988, 2019-09

    3
    Article
    Single-crystalline Co2Si nanowires directly synthesized on silicon substrate for high-performance micro-supercapacitor

    Lee, Jiyoung; Yoo, Chung-Yul; Lee, Yeong A.; et al, CHEMICAL ENGINEERING JOURNAL, v.370, pp.973 - 979, 2019-08

    4
    Article
    Performance of ACE-Reaction on 26 Organic Reactions for Fully Automated Reaction Network Construction and Microkinetic Analysis

    Kim, Jin Woo; Kim, Yeonjoon; Baek, Kyung Yup; et al, JOURNAL OF PHYSICAL CHEMISTRY A, v.123, no.22, pp.4796 - 4805, 2019-06

    5
    Article
    Quantum transport properties of single-crystalline Ag2Se0.5Te0.5 nanowires as a new topological material

    Kim, Minjin; Kim, Jihwan; Lee, In-Ho; et al, NANOSCALE, v.11, no.12, pp.5171 - 5179, 2019-03

    6
    Article
    Study of Li Adsorption on Graphdiyne Using Hybrid DFT Calculations

    Kim, Jaewook; Kang, Sungwoo; Lim, Jaechang; et al, ACS APPLIED MATERIALS & INTERFACES, v.11, no.3, pp.2677 - 2683, 2019-01

    7
    Article
    Poly(amide-imide) materials for transparent and flexible displays

    Kim, Sun Dal; Lee, Byungyong; Byun, Taejoon; et al, SCIENCE ADVANCES, v.4, no.10, 2018-10

    8
    Article
    Kohn-Sham approach for fast hybrid density functional calculations in real-space numerical grid methods

    Kim, Jaewook; Kang, Sungwoo; Lim, Jaechang; et al, COMPUTER PHYSICS COMMUNICATIONS, v.230, pp.21 - 26, 2018-09

    9
    Article
    On the achievement of high fidelity and scalability for large-scale diagonalizations in grid-based DFT simulations

    Choi, Sunghwan; Kim, Woo Younresearcher; Yeom, Min Sun; et al, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.118, no.16, 2018-08

    10
    Article
    Feasibility of Activation Energy Prediction of Gas-Phase Reactions by Machine Learning

    Choi, Sunghwan; Kim, Yeonjoon; Kim, Jin Woo; et al, CHEMISTRY-A EUROPEAN JOURNAL, v.24, no.47, pp.12354 - 12358, 2018-08

    11
    Article
    Molecular generative model based on conditional variational autoencoder for de novo molecular design

    Lim, Jaechang; Ryu, Seongok; Kim, Jin Woo; et al, JOURNAL OF CHEMINFORMATICS, v.10, 2018-07

    12
    Article
    Fragment-orbital tunneling currents and electronic couplings for analysis of molecular charge-transfer systems

    Hwang, Sang-Yeon; Kim, Jaewook; Kim, Woo Younresearcher, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.20, no.14, pp.9146 - 9156, 2018-04

    13
    Article
    Efficient structural elucidation of microhydrated biomolecules through the interrogation of hydrogen bond networks

    Kim, Yeonjoon; Kim, Jaewook; Baek, Kyung Yup; et al, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.20, no.12, pp.8185 - 8191, 2018-03

    14
    Article
    Efficient prediction of reaction paths through molecular graph and reaction network analysis

    Kim, Yeonjoon; Kim, Jin Woo; Kim, Zeehyo; et al, CHEMICAL SCIENCE, v.9, no.4, pp.825 - 835, 2018-01

    15
    Article
    Non-empirical atomistic dipole-interaction-model for quantum plasmon simulation of nanoparticles

    Lim, Jaechang; Kang, Sungwoo; Kim, Jaewook; et al, SCIENTIFIC REPORTS, v.7, 2017-11

    16
    Article
    Effects of the locality of a potential derived from hybrid density functionals on Kohn-Sham orbitals and excited states

    Kim, Jaewook; Hong, Kwang-Woo; Hwang, Sang-Yeon; et al, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.19, no.15, pp.10177 - 10186, 2017-04

    17
    Article
    Outstanding performance of configuration interaction singles and doubles using exact exchange Kohn-Sham orbitals in real-space numerical grid method

    Lim, Jaechang; Choi, Sunghwan; Kim, Jaewook; et al, JOURNAL OF CHEMICAL PHYSICS, v.145, no.22, 2016-12

    18
    Article
    Improvement of initial guess via grid-cutting for efficient grid-based density functional calculations

    Lim, Jaechang; Choi, Sunghwan; Kang, Sungwoo; et al, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.19, pp.1397 - 1403, 2016-10

    19
    Article
    Performance of heterogeneous computing with graphics processing unit and many integrated core for hartree potential calculations on a numerical grid

    Choi, Sunghwan; Kwon, Oh Kyoung; Kim, Jaewook; et al, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.37, no.24, pp.2193 - 2201, 2016-09

    20
    Article
    Enhancing the Activity of Platinum-Based Nanocrystal Catalysts for Organic Synthesis through Electronic Structure Modification

    Kim, Minjune; Kim, Yena; Kim, Yeonjoon; et al, CHEMCATCHEM, v.8, no.15, pp.2450 - 2454, 2016-08

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