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Yu Harabuchi

hokkaido university

26H-index
154Paper Count
3.1KCitation Count
Published Papers 47
Publication Date
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Revisiting C4N4 Fluorophore: Theoretical Elucidation of the Origin of Fluorescent Properties of 2,5-Diaminopyrimidines and Strategic Applications to Pd Detection
errChemistry-A European Journal
IF3.7
err2026-02-01
err0
errOAAI
errKohei, Miki; Kondo, Itsuki; Kawamura, Go; Harabuchi, Yu; Maeda, Satoshi; Kumagai, Naoya
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“Node” facilitated thermostable mechanophores for rapid self-strengthening in double network materials
errChem. Sci.
IF7.4
err2025-08-06
err0
errOAAI
errJulong Jiang ‡; Zhi Jian Wang ‡; Ruben Staub; Yu Harabuchi; Alexandre Varnek; Jian Ping Gong; Satoshi Maeda
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Computationally Guided Development of an Alkene Aminocarboxylation with CO2: Synthesis of a β-Amino Acid Derivative
errACS Catalysis
IF13.1
err2025-07-04
err0
PREAI
errWataru Kanna; Yu Harabuchi; Kosaku Tanaka III; Hiroki Hayashi; Hideaki Takano; Tomoki Kozuka; Hiroto Sakurai; Nobuyuki Mase; Satoshi Maeda; Tsuyoshi Mita
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Photocatalytic Cyclization of 2-Phosphinobiaryls to Trivalent Dibenzophospholes
errACS CATALYSIS
IF13.1
err2025-04-07
err0
PREAI
errMasuda, Y; Harabuchi, Y; Kawamura, Y; Morooka, N; Maeda, S; Sawamura, M
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errSave
Elucidating multicomponent mechanisms in the catalytic hydrogenation of 2-methylquinoline under crude-H2 conditions: a key H2-cleavage process by a boron-olefin Lewis pair
errBULLETIN OF THE CHEMICAL SOCIETY OF JAPAN
IF3.8
err2024-12-30
err0
PREAI
errHashimoto, Taiki; Harabuchi, Yu; Ogoshi, Sensuke; Maeda, Satoshi; Hoshimoto, Yoichi
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Virtual Ligand-Assisted Optimization: A Rational Strategy for Ligand Engineering
errACS CATALYSIS
IF13.1
err2024-10-21
err0
errOAAI
errMatsuoka, Wataru; Oki, Taihei; Yamada, Ren; Yokoyama, Tomohiko; Suda, Shinichi; Saunders, Carla M.; Skjelstad, Bastian Bjerkem; Harabuchi, Yu; Fey, Natalie; Iwata, Satoru; Maeda, Satoshi
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Tetraborylation of p-Benzynes Generated by the Masamune-Bergman Cyclization through Reaction Design Based on the Reaction Path Network
errJACS AU
IF8.7
err2024-06-20
err0
errOAAI
errNakatsuka, Soichiro; Akiyama, Seiji; Harabuchi, Yu; Maeda, Satoshi; Nagata, Yuuya
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Photoinduced dual bond rotation of a nitrogen-containing system realized by chalcogen substitution
errNATURE CHEMISTRY
IF20.2
err2024-02-28
err0
errOAAI
errNagami, Shotaro; Kaguchi, Rintaro; Akahane, Taichi; Harabuchi, Yu; Taniguchi, Tohru; Monde, Kenji; Maeda, Satoshi; Ichikawa, Satoshi; Katsuyama, Akira
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Exploring Downhill Bifurcations in [3,3]-Sigmatropic Rearrangement by Finding Transitions from an Uphill Bifurcation to a Downhill Bifurcation
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-02-05
err1
PREAI
errIto, Takuma; Maeda, Satoshi; Harabuchi, Yu
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Challenges for Kinetics Predictions via Neural Network Potentials: A Wilkinson's Catalyst Case
errMOLECULES
IF4.6
err2023-05-31
err6
errOAAI
errStaub, Ruben; Gantzer, Philippe; Harabuchi, Yu; Maeda, Satoshi; Varnek, Alexandre
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Toward Ab Initio Reaction Discovery Using the Artificial Force Induced Reaction Method
errANNUAL REVIEW OF PHYSICAL CHEMISTRY
IF11.7
err2023-04-24
err10
errOAAI
errMaeda, Satoshi; Harabuchi, Yu; Hayashi, Hiroki; Mita, Tsuyoshi
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Virtual Ligand Strategy in Transition Metal Catalysis Toward Highly Efficient Elucidation of Reaction Mechanisms and Computational Catalyst Design
errACS CATALYSIS
IF13.1
err2023-04-12
err11
errOAAI
errMatsuoka, Wataru; Harabuchi, Yu; Maeda, Satoshi
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Exploring the Quantum Chemical Energy Landscape with GNN- Guided Artificial Force
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-01-23
err4
errOAAI
errNakao, Atsuyuki; Harabuchi, Yu; Maeda, Satoshi; Tsuda, Koji
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Searching chemical action and network (SCAN): an interactive chemical reaction path network platform
errDIGITAL DISCOVERY
IF5.6
err2023-01-01
err8
errOAAI
errKuwahara, Mikael; Harabuchi, Yu; Maeda, Satoshi; Fujima, Jun; Takahashi, Keisuke
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Prediction of High-Yielding Single-Step or Cascade Pericyclic Reactions for the Synthesis of Complex Synthetic Targets
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2022-12-01
err7
PREAI
errMita, Tsuyoshi; Takano, Hideaki; Hayashi, Hiroki; Kanna, Wataru; Harabuchi, Yu; Houk, K. N.; Maeda, Satoshi
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errSave
Oxidation and Reduction Pathways in the Knowles Hydroamination via a Photoredox-Catalyzed Radical Reaction
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2022-11-28
err6
PREAI
errHarabuchi, Yu; Hayashi, Hiroki; Takano, Hideaki; Mita, Tsuyoshi; Maeda, Satoshi
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A theory-driven synthesis of symmetric and unsymmetric 1,2-bis(diphenylphosphino)ethane analogues via radical difunctionalization of ethylene
errNATURE COMMUNICATIONS
IF15.7
err2022-11-21
err4
errOAAI
errTakano, Hideaki; Katsuyama, Hitomi; Hayashi, Hiroki; Kanna, Wataru; Harabuchi, Yu; Maeda, Satoshi; Mita, Tsuyoshi
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In silico reaction screening with difluorocarbene for N-difluoroalkylative dearomatization of pyridines
errNATURE SYNTHESIS
IF20
err2022-08-08
err16
errOAAI
errHayashi, Hiroki; Katsuyama, Hitomi; Takano, Hideaki; Harabuchi, Yu; Maeda, Satoshi; Mita, Tsuyoshi
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Quantum Chemical Calculations to Trace Back Reaction Paths for the Prediction of Reactants
errJACS AU
IF8.7
err2022-04-22
err24
errOAAI
errSumiya, Yosuke; Harabuchi, Yu; Nagata, Yuuya; Maeda, Satoshi
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Virtual Ligand-Assisted Screening Strategy to Discover EnablingLigands for Transition Metal Catalysis
errACS CATALYSIS
IF13.1
err2022-03-13
err14
errOAAI
errMatsuoka, Wataru; Harabuchi, Yu; Maeda, Satoshi
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Research Directions

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Co-authors
Cooperation Journals
K
K. N. Houk
H-index: 157 · Papers: 2.6K
K
Keiji Morokuma
H-index: 108 · Papers: 1.4K
J
Jian Ping Gong
H-index: 99 · Papers: 827
M
Mark S. Gordon
H-index: 90 · Papers: 734
M
Masaya Sawamura
H-index: 79 · Papers: 564
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