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Implementation and performance of the artificial force induced reaction method in the GRRM17 program

Journal of computational chemistry, 2018-02, Vol.39 (4), p.233-251

2018

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Theoretical study on mechanism of dioxygen evolution in photosystem II. II. Molecular and electronic structures at the S3 and S4 states of oxygen-evolving complex

Chemical physics letters, 2014-03, Vol.595-596, p.237-241

2014

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An autocatalytic cycle in autoxidation of triethylborane

Chemical communications (Cambridge, England), 2017, Vol.53 (53), p.7302-7305

2017

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Zn(OTf) 2 -mediated annulations of N -propargylated tetrahydrocarbolines: divergent synthesis of four distinct alkaloidal scaffolds

Chemical science (Cambridge), 2019-06, Vol.10 (22), p.5686-5698

2019

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Which oxidation state is preferable at S0 state in oxygen-evolving complex, Mn4(II, III, IV, IV) or Mn4(III, III, III, IV)? A B3LYP study

Chemical physics letters, 2012-08, Vol.545, p.107-111

2012

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Size-dependent reactivity of Rh cationic clusters to reduce NO by CO in the gas phase at high temperatures

Physical chemistry chemical physics : PCCP, 2024-05, Vol.26 (17), p.13131-13139

2024

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A Systematic Study on Bond Activation Energies of NO, N 2 , and O 2 on Hexamers of Eight Transition Metals

ChemCatChem, 2019-02, Vol.11 (4), p.1346-1353

2019

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A Systematic Study on Bond Activation Energies of NO, N2, and O2 on Hexamers of Eight Transition Metals

ChemCatChem, 2019-02, Vol.11 (4), p.1346-1353

2019

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Targeted 1,3-dipolar cycloaddition with acrolein for cancer prodrug activation

Chemical science (Cambridge), 2021-04, Vol.12 (15), p.5438-5449

2021

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Strain-based design, direct macrocyclization, and metal complexation of thiazole-containing calix[3]pyrrole analogues

Inorganic chemistry frontiers, 2024, Vol.11 (12), p.3548-3554

2024

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Zn(OTf)2-mediated annulations of N-propargylated tetrahydrocarbolines: divergent synthesis of four distinct alkaloidal scaffolds† †Electronic supplementary information (ESI) available. CCDC 1905889, 1905890 and 1905916. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c9sc01507h

Chemical science (Cambridge), 2019-05, Vol.10 (22), p.5686-5698

2019

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An autocatalytic cycle in autoxidation of triethylboraneElectronic supplementary information (ESI) available. See DOI: 10.1039/c7cc02541f

2017-06

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2P255 OECのKok-S2状態の反応活性部位の分子構造に関するB3LYP計算 : Mn4の配位水分子のプロトン化状態(18B. 光生物:光合成,ポスター,第52回日本生物物理学会年会(2014年度))

生物物理, 2014/08/20, Vol.54(supplement1-2), pp.S237

2014

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2P255 A B3LYP study on molecular structures of active site at the Kok-S2 state of OEC: protonation states of Mn4-ligated water molecules(18B. Photobiology:Photosynthesis,Poster)

Seibutsu Butsuri, 2014/08/20, Vol.54(supplement1-2), pp.S237

2014

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1P252 OECのS3状態の反応活性部位の分子構造と酸化状態に関する理論的研究(18B. 光生物:光合成,ポスター,日本生物物理学会年会第51回(2013年度))

生物物理, 2013/09/13, Vol.53(supplement1-2), pp.S147

2013

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1P252 Theoretical study on molecular structures and oxidation states of active site at the S3 state of OEC(18B. Photobiology: Photosynthesis,Poster)

Seibutsu Butsuri, 2013/09/13, Vol.53(supplement1-2), pp.S147

2013

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Zn(OTf)-mediated annulations of -propargylated tetrahydrocarbolines: divergent synthesis of four distinct alkaloidal scaffolds

Chemical science (Cambridge), 2019-06, Vol.1 (22), p.5686-5698

2019

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Angular vortex phase diagram in YBa2Cu3O7 films with c-axis correlated pinning centers

Superconductor science & technology, 2021-08, Vol.34 (8)

2021

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Convergent evolution of the UbiA prenyltransferase family underlies the independent acquisition of furanocoumarins in plants

The New phytologist, 2020-03, Vol.225 (5), p.2166-2182

2020

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Angular vortex phase diagram in YBa 2 Cu 3 O 7 films with c-axis correlated pinning centers

Superconductor science & technology, 2021-08, Vol.34 (8), p.85015

2021

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Parallel evolution of UbiA superfamily proteins into aromatic O -prenyltransferases in plants

Proceedings of the National Academy of Sciences - PNAS, 2021-04, Vol.118 (17), p.1

2021

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Variation of c -axis correlation on vortex pinning by ab -plane non-superconducting layers in YBa2Cu3O7 films

Journal of applied physics, 2013-08, Vol.114 (7)

2013

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Anonymizing Face Images by Using Similarity-Based Metric

2013 International Conference on Availability, Reliability and Security, 2013, p.517-524

2013

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Development of New HSS Roll with High Heat Crack Resistance by Reinforced Carbides

Materia Japan, 2000/02/20, Vol.39(2), pp.181-183

2000

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Iron Castings with High Atomospheric Corrosion Resistance for Landscape

Journal of Japan Foundry Engineering Society, 1997/02/25, Vol.69(2), pp.164-170

1997

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Implementation and performance of the artificial force induced reaction method in the GRRM17 program

Theoretical study on mechanism of dioxygen evolution in photosystem II. II. Molecular and electronic structures at the S3 and S4 states of oxygen-evolving complex

An autocatalytic cycle in autoxidation of triethylborane

Zn(OTf) 2 -mediated annulations of N -propargylated tetrahydrocarbolines: divergent synthesis of four distinct alkaloidal scaffolds

Which oxidation state is preferable at S0 state in oxygen-evolving complex, Mn4(II, III, IV, IV) or Mn4(III, III, III, IV)? A B3LYP study

Size-dependent reactivity of Rh cationic clusters to reduce NO by CO in the gas phase at high temperatures

A Systematic Study on Bond Activation Energies of NO, N 2 , and O 2 on Hexamers of Eight Transition Metals

A Systematic Study on Bond Activation Energies of NO, N2, and O2 on Hexamers of Eight Transition Metals

Targeted 1,3-dipolar cycloaddition with acrolein for cancer prodrug activation

Strain-based design, direct macrocyclization, and metal complexation of thiazole-containing calix[3]pyrrole analogues

An autocatalytic cycle in autoxidation of triethylboraneElectronic supplementary information (ESI) available. See DOI: 10.1039/c7cc02541f

2P255 OECのKok-S2状態の反応活性部位の分子構造に関するB3LYP計算 : Mn4の配位水分子のプロトン化状態(18B. 光生物:光合成,ポスター,第52回日本生物物理学会年会(2014年度))

2P255 A B3LYP study on molecular structures of active site at the Kok-S2 state of OEC: protonation states of Mn4-ligated water molecules(18B. Photobiology:Photosynthesis,Poster)

1P252 OECのS3状態の反応活性部位の分子構造と酸化状態に関する理論的研究(18B. 光生物:光合成,ポスター,日本生物物理学会年会第51回(2013年度))

1P252 Theoretical study on molecular structures and oxidation states of active site at the S3 state of OEC(18B. Photobiology: Photosynthesis,Poster)

Zn(OTf)-mediated annulations of -propargylated tetrahydrocarbolines: divergent synthesis of four distinct alkaloidal scaffolds

Angular vortex phase diagram in YBa2Cu3O7 films with c-axis correlated pinning centers

Convergent evolution of the UbiA prenyltransferase family underlies the independent acquisition of furanocoumarins in plants

Angular vortex phase diagram in YBa 2 Cu 3 O 7 films with c-axis correlated pinning centers

Parallel evolution of UbiA superfamily proteins into aromatic O -prenyltransferases in plants

Variation of c -axis correlation on vortex pinning by ab -plane non-superconducting layers in YBa2Cu3O7 films

Anonymizing Face Images by Using Similarity-Based Metric

Development of New HSS Roll with High Heat Crack Resistance by Reinforced Carbides

Iron Castings with High Atomospheric Corrosion Resistance for Landscape

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