Journal of the Korean Chemical Society

Investigating Chemical Interpretability in Graph Neural Networks via Atom-wise Shapley Additive Explanations

Hyeonsu Je JaeHun Kim Yeonjoon Kim
Vol. 69, No. 4, pp. 165-176, Aug. 2025

10.5012/jkcs.2025.69.4.165

Graph Neural Networks

Chemical interpretability

Shapley additive explanations

Impact of the S20G Mutation on the Structural and Aggregation Properties of hIAPP Monomers

Chuanbo Wang Pengfei Li Xin Pu Baotao Kang
Vol. 69, No. 4, pp. 177-183, Aug. 2025

10.5012/jkcs.2025.69.4.177

type 2 diabetes

Protein misfolding

Human islet amyloid polypeptide

Histidine behavior

Molecular dynamics simulation

Nanoparticles as Drug Delivery Systems

Bongrae Cho
Vol. 69, No. 4, pp. 184-187, Aug. 2025

10.5012/jkcs.2025.69.4.184

Hollow porous nanoparticle

Glucagon-like peptide-1

Enfuvirtide

Minoxidil

The Effects of an Argument-based Collaborative Information Analysis Activities on Middle School Students’ Judgments of Scientific Information Credibility

Minji Ju Dojun Jung Jeonghee Nam
Vol. 69, No. 4, pp. 188-200, Aug. 2025

10.5012/jkcs.2025.69.4.188

Judgments of scientific information

Argument

Collaborative information analysis activity

Ozonolysis of β-Phellandrene via Criegee Intermediates: Mechanistic Insights from DFT Calculation

Jiho Park Hahkjoon Kim
Vol. 69, No. 4, pp. 201-205, Aug. 2025

10.5012/jkcs.2025.69.4.201

β-Phellandrene

Ozonolysis

Criegee Intermediates

DFT calculations

Thioacetal Formation via Endo-cleavage of THP-protected Thioethers

Junseong Ahn Seora Kim Sung Jun Hong Choon Woo Lim
Vol. 69, No. 4, pp. 206-209, Aug. 2025

10.5012/jkcs.2025.69.4.206

Thioether

Thioacetal

Endo-cleavage

Digital Library

Investigating Chemical Interpretability in Graph Neural Networks via Atom-wise Shapley Additive Explanations

Impact of the S20G Mutation on the Structural and Aggregation Properties of hIAPP Monomers

Nanoparticles as Drug Delivery Systems

The Effects of an Argument-based Collaborative Information Analysis Activities on Middle School Students’ Judgments of Scientific Information Credibility

Ozonolysis of β-Phellandrene via Criegee Intermediates: Mechanistic Insights from DFT Calculation

Thioacetal Formation via Endo-cleavage of THP-protected Thioethers

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Investigating Chemical Interpretability in Graph Neural Networks via Atom-wise Shapley Additive Explanations

Impact of the S20G Mutation on the Structural and Aggregation Properties of hIAPP Monomers

Nanoparticles as Drug Delivery Systems

The Effects of an Argument-based Collaborative Information Analysis Activities on Middle School Students’ Judgments of Scientific Information Credibility

Ozonolysis of β-Phellandrene via Criegee Intermediates: Mechanistic Insights from DFT Calculation

Thioacetal Formation via Endo-cleavage of THP-protected Thioethers

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