| 2019 | A Mn(iv)-peroxo complex in the reactions with proton donors | 남원우; 이용민 | Article |
| 2021 | A Mononuclear Non-heme Iron(III)-Peroxo Complex with an Unprecedented High O-O Stretch and Electrophilic Reactivity | 남원우; 이용민; 서미숙 | Article |
| 2021 | Electronic properties and reactivity patterns of high-valent metal-oxo species of Mn, Fe, Co, and Ni | 남원우; Li Xiao Xi | Article |
| 2020 | Enhanced Redox Reactivity of a Nonheme Iron(V)-Oxo Complex Binding Proton | 남원우; Shunichi Fukuzumi; 김선희; 서미숙; 김원석 | Article |
| 2019 | High-Spin Mn(V)-Oxo Intermediate in Nonheme Manganese Complex-Catalyzed Alkane Hydroxylation Reaction: Experimental and Theoretical Approach | 남원우 | Article |
| 2018 | Highly Enantioselective Oxidation of Spirocyclic Hydrocarbons by Bioinspired Manganese Catalysts and Hydrogen Peroxide | 남원우 | Article |
| 2021 | How does Lewis acid affect the reactivity of mononuclear high-valent chromium-oxo species? A theoretical study | 남원우; 이용민; Li Xiao Xi | Article |
| 2018 | Mn(III)-lodosylarene Porphyrins as an Active Oxidant in Oxidation Reactions: Synthesis, Characterization, and Reactivity Studies | 남원우; 이용민; Shunichi Fukuzumi; 김원석; Mian Guo | Article |
| 2021 | Nonheme Iron Imido Complexes Bearing a Non-Innocent Ligand: A Synthetic Chameleon Species in Oxidation Reactions | 남원우 | Article |
| 2017 | Reactivity Patterns of (Protonated) CompoundII and CompoundI of Cytochrome P450: Which is the Better Oxidant? | 남원우 | Article |
| 2019 | Regioselective Oxybromination of Benzene and Its Derivatives by Bromide Anion with a Mononuclear Nonheme Mn(IV)-Oxo Complex | 남원우; 이용민; Shunichi Fukuzumi | Article |
| 2023 | Seeing the cis-Dihydroxylating Intermediate: A Mononuclear Nonheme Iron-Peroxo Complex in cis-Dihydroxylation Reactions Modeling Rieske Dioxygenases | 남원우; 이용민; 서미숙; Li Xiao Xi; Akhilesh Kumar | Article |
| 2019 | Small Reorganization Energy for Ligand-Centered Electron-Transfer Reduction of Compound I to Compound II in a Heme Model Study | 남원우; Shunichi Fukuzumi | Article |
| 2023 | Theoretical investigation on the elusive structure-activity relationship of bioinspired high-valence nickel-halogen complexes in oxidative fluorination reactions | 남원우 | Article |
| 2019 | Tunneling Controls the Reaction Pathway in the Deformylation of Aldehydes by a Nonheme Iron(III)-Hydroperoxo Complex: Hydrogen Atom Abstraction versus Nucleophilic Addition | 남원우; 이용민; Shunichi Fukuzumi; 서미숙 | Article |
| 2017 | Tunneling Effect That Changes the Reaction Pathway from Epoxidation to Hydroxylation in the Oxidation of Cyclohexene by a Compound I Model of Cytochrome P450 | 남원우; 이용민; Shunichi Fukuzumi; Mian Guo | Article |
