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PyQSAR: A Fast QSAR Modeling Platform Using Machine Learning and Jupyter Notebook

Bulletin of the Korean Chemical Society, 2019, 40(1), , pp.39-44

2019

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Pyrido[3,4‐d]pyrimidine as an Acceptor of Thermally Activated Delayed Fluorescent Emitters: Time‐dependent Density Functional Theory Study

Bulletin of the Korean Chemical Society, 2021, 42(7), , pp.977-982

2021

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Prediction of human cytochrome P450 inhibition using bio‐selectivity induced deep neural network

Bulletin of the Korean Chemical Society, 2022, 43(2), , pp.261-269

2022

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Water Molecules on the Epoxide Groups of Graphene Oxide Surfaces

Bulletin of the Korean Chemical Society, 2018, 39(11), , pp.1320-1323

2018

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Identification of Isomers of Organometallic Compounds

Bulletin of the Korean Chemical Society, 2015, 36(6), , pp.1569-1574

2015

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Luminescent properties of 4‐aminobenzo‐15‐crown‐5 after preferential binding of ferric ions in aqueous solutions

Luminescence (Chichester, England), 2017-06, Vol.32 (4), p.549-554

2017

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A New Efficient Conformational Search Method for ab initio Protein Folding Study: Window Growth Evolutionary Algorithm

Bulletin of the Korean Chemical Society, 2016, 37(12), , pp.1971-1976

2016

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In Silico Development of Quorum‐Sensing Inhibitors

Bulletin of the Korean Chemical Society, 2017, 38(7), , pp.728-734

2017

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Gold Nanoparticle-based Surface-enhanced Raman Scattering Fe(III) Ion Sensor

Bulletin of the Korean Chemical Society, 2015, 36(1), , pp.244-249

2015

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Quantitative Structure-Relative Volatility Relationship Model for Extractive Distillation of Ethylbenzene/p-Xylene Mixtures: Application to Binary and Ternary Mixtures as Extractive Agents

Bulletin of the Korean Chemical Society, 2016, 37(4), , pp.548-555

2016

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Structure Identification of Novel Compounds Using Simple IR, 1H, and 13C NMR Spectroscopy and Computational Tools

Bulletin of the Korean Chemical Society, 2020, 41(1), , pp.78-83

2020

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A Density Functional Theory Study of Additives in Electrolytes of a Dye Sensitized Solar Cell

Bulletin of the Korean Chemical Society, 2013, 34(8), , pp.2491-2494

2013

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Raman Spectroscopy and Density Functional Theory Calculations of β-Glucans and Chitins in Fungal Cell Walls

Bulletin of the Korean Chemical Society, 2013, 34(3), , pp.943-945

2013

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Identification of Potent Inhibitors against Human Peptide Deformylase as Anticancer Agents

Bulletin of the Korean Chemical Society, 2013, 34(12), , pp.3885-3887

2013

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Tautomerism of Cytosine on Silver, Gold, and Copper: Raman Spectroscopy and Density Functional Theory Calculation Study

Bulletin of the Korean Chemical Society, 2008, 29(1), , pp.69-75

2008

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Ab initio MO Study on N-Nitrosoazetidine-2-carboxylic Acid

Bulletin of the Korean Chemical Society, 2005, 26(1), , pp.32-33

Cho, Kwang-Hwi

2005

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QM Scoring Function and its Application to TOP1 Inhibitors

Bulletin of the Korean Chemical Society, 2011, 32(4), , pp.1127-1128

2011

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Structure Identification of Novel Compounds Using Simple IR, 1 H, and 13 C NMR Spectroscopy and Computational Tools

Bulletin of the Korean Chemical Society, 2020-01, Vol.41 (1), p.78-83

2020

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A Density Functional Theory Study of Additives in Electrolytes of a Dye Sensitized Solar Cell

Bulletin of the Korean Chemical Society, 2013, Vol.34 (8), p.2491-2494

2013

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Identification of Potent Inhibitors against Human Peptide Deformylase as Anticancer Agents

Bulletin of the Korean Chemical Society, 2013, Vol.34 (12), p.3885-3887

2013

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QM Scoring Function and its Application to TOP1 Inhibitors

Bulletin of the Korean Chemical Society, 2011, Vol.32 (4), p.1127-1128

2011

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Raman Spectroscopy and Density Functional Theory Calculations of β-Glucans and Chitins in Fungal Cell Walls

Bulletin of the Korean Chemical Society, 2013, Vol.34 (3), p.943-945

2013

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Tautomerism of Cytosine on Silver, Gold, and Copper: Raman Spectroscopy and Density Functional Theory Calculation Study

Bulletin of the Korean Chemical Society, 2008, Vol.29 (1), p.69-75

2008

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Direct and Highly Efficient Estimation of the Entropy through the Canonical Ensemble Average of Acceptance Ratios

Bulletin of the Korean Chemical Society, 2005, Vol.26 (11), p.1673-1674

2005

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ChemInform Abstract: New Combined Model for the Prediction of Regioselectivity in Cytochrome P450/3A4 Mediated Metabolism

ChemInform, 2008-06, Vol.39 (24), p.no-no

2008

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PyQSAR: A Fast QSAR Modeling Platform Using Machine Learning and Jupyter Notebook

Pyrido[3,4‐d]pyrimidine as an Acceptor of Thermally Activated Delayed Fluorescent Emitters: Time‐dependent Density Functional Theory Study

Prediction of human cytochrome P450 inhibition using bio‐selectivity induced deep neural network

Water Molecules on the Epoxide Groups of Graphene Oxide Surfaces

Identification of Isomers of Organometallic Compounds

Luminescent properties of 4‐aminobenzo‐15‐crown‐5 after preferential binding of ferric ions in aqueous solutions

A New Efficient Conformational Search Method for ab initio Protein Folding Study: Window Growth Evolutionary Algorithm

In Silico Development of Quorum‐Sensing Inhibitors

Gold Nanoparticle-based Surface-enhanced Raman Scattering Fe(III) Ion Sensor

Quantitative Structure-Relative Volatility Relationship Model for Extractive Distillation of Ethylbenzene/p-Xylene Mixtures: Application to Binary and Ternary Mixtures as Extractive Agents

Structure Identification of Novel Compounds Using Simple IR, 1H, and 13C NMR Spectroscopy and Computational Tools

A Density Functional Theory Study of Additives in Electrolytes of a Dye Sensitized Solar Cell

Raman Spectroscopy and Density Functional Theory Calculations of β-Glucans and Chitins in Fungal Cell Walls

Identification of Potent Inhibitors against Human Peptide Deformylase as Anticancer Agents

Tautomerism of Cytosine on Silver, Gold, and Copper: Raman Spectroscopy and Density Functional Theory Calculation Study

Ab initio MO Study on N-Nitrosoazetidine-2-carboxylic Acid

QM Scoring Function and its Application to TOP1 Inhibitors

Structure Identification of Novel Compounds Using Simple IR, 1 H, and 13 C NMR Spectroscopy and Computational Tools

A Density Functional Theory Study of Additives in Electrolytes of a Dye Sensitized Solar Cell

Identification of Potent Inhibitors against Human Peptide Deformylase as Anticancer Agents

QM Scoring Function and its Application to TOP1 Inhibitors

Raman Spectroscopy and Density Functional Theory Calculations of β-Glucans and Chitins in Fungal Cell Walls

Tautomerism of Cytosine on Silver, Gold, and Copper: Raman Spectroscopy and Density Functional Theory Calculation Study

Direct and Highly Efficient Estimation of the Entropy through the Canonical Ensemble Average of Acceptance Ratios

ChemInform Abstract: New Combined Model for the Prediction of Regioselectivity in Cytochrome P450/3A4 Mediated Metabolism

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