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Chemical Engineering and Industrial Chemistry

Working Paper

Comprehensive COSMO-RS Exploration of Highly CO2 Selective Hydrogen-bonding Binary Absorbents even under Humid Conditions

Shiori Watabe, Nahoko Kuroki, Hirotoshi Mori

Version 1 posted 29 November 2022

199

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Theoretical and Computational Chemistry

Working Paper

Nuclear Coupled Electronic States Analyses Expose Nuclear Quantum Effects in Nucleobase Pairs

Kohei Motoki, Hirotoshi Mori

Version 1 posted 06 February 2025

119

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Biological and Medicinal Chemistry

Working Paper

Biological Active Region Defined by Fragment-based Molecular Theory

Nichika Ozawa, Hirotoshi Mori, Nahoko Kuroki

Version 1 posted 03 June 2024

154

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Theoretical and Computational Chemistry

Working Paper

Ultrafast Realization of Ionic Liquids with Excellent CO2 Absorption: A trinity study of machine learning, synthesis, and precision measurement

Nahoko Kuroki, Yuki Suzuki, Daisuke Kodama, Firoz Alam Chowdhury, Hidetaka Yamada, Hirotoshi Mori

Version 1 posted 24 June 2022

469

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3

Citations

Theoretical and Computational Chemistry

Working Paper

Electronic fluctuation in physiological solutions: Trimethylamine N-oxide and tert-butyl alcohol

Nahoko Kuroki, Yukina Uchino, Tamon Funakura, Hirotoshi Mori

Version 1 posted 20 April 2022

225

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Theoretical and Computational Chemistry

Working Paper

Beyond Born-Oppenheimer pharmaceutical quantum chemistry of thalidomide analogs and deuterium substituents

Kohei Motoki, Hirotoshi Mori

Version 1 posted 30 May 2023

216

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Theoretical and Computational Chemistry

Working Paper

Nuclear Quantum Effects in Chemical Bonding Theory: Inter/Intramolecular Hydrogen-Bonding Interactions

Kohei Motoki, Hirotoshi Mori

Version 1 posted 25 November 2024

161

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Materials Chemistry

Working Paper

Realizing Ultra-Fine Color Tuning of Organic Electronics Materials by Electronic State Informatics

Daisuke Goto, Yusuke Kanebako, Kengo Takashima, Nahoko Kuroki, Hirotoshi Mori

Version 1 posted 18 November 2024

124

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Materials Chemistry

Working Paper

Optimizing Multiple Electronic Functions of Organic Electronics Materials by Electronic State Informatics

Daisuke Goto, Hirotoshi Mori

Version 1 posted 18 November 2024

185

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Refine Search

9 results in Hirotoshi Mori in Authors: Hirotoshi Mori

Comprehensive COSMO-RS Exploration of Highly CO2 Selective Hydrogen-bonding Binary Absorbents even under Humid Conditions

Nuclear Coupled Electronic States Analyses Expose Nuclear Quantum Effects in Nucleobase Pairs

Biological Active Region Defined by Fragment-based Molecular Theory

Ultrafast Realization of Ionic Liquids with Excellent CO2 Absorption: A trinity study of machine learning, synthesis, and precision measurement

Electronic fluctuation in physiological solutions: Trimethylamine N-oxide and tert-butyl alcohol

Beyond Born-Oppenheimer pharmaceutical quantum chemistry of thalidomide analogs and deuterium substituents

Nuclear Quantum Effects in Chemical Bonding Theory: Inter/Intramolecular Hydrogen-Bonding Interactions

Realizing Ultra-Fine Color Tuning of Organic Electronics Materials by Electronic State Informatics

Optimizing Multiple Electronic Functions of Organic Electronics Materials by Electronic State Informatics

9 results in Authors: Hirotoshi Mori