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Limited solvation of an electron donating tryptophan stabilizes a photoinduced charge-separated state in plant (6-4) photolyase

Scientific reports, 2022-03, Vol.12 (1), p.5084-5084, Article 5084

2022

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A Strap Strategy for Construction of an Excited-State Intramolecular Proton Transfer (ESIPT) System with Dual Fluorescence

Angewandte Chemie (International ed.), 2014-07, Vol.53 (31), p.8231-8235

International ed. in English, 2014

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FMO3-LCMO study of electron transfer coupling matrix element and pathway: Application to hole transfer between two tryptophans through cis- and trans-polyproline-linker systems

The Journal of chemical physics, 2016-09, Vol.145 (11)

2016

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Synergetic Effects of Triplet–Triplet Annihilation and Directional Triplet Exciton Migration in Organic Crystals for Photon Upconversion

The journal of physical chemistry letters, 2018-11, Vol.9 (22), p.6638-6643

2018

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Dynamical free energy based model for quantum decision making

Physica A, 2022-11, Vol.605, p.127979, Article 127979

2022

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Förster Resonance Energy Transfer between Fluorescent Proteins: Efficient Transition Charge-Based Study

Journal of physical chemistry. C, 2017-03, Vol.121 (8), p.4220-4238

2017

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Electron Transfer Pathways of Cyclobutane Pyrimidine Dimer Photolyase Revisited

The journal of physical chemistry. B, 2018-07, Vol.122 (27), p.6912-6921

2018

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Near infrared two-photon-excited and -emissive dyes based on a strapped excited-state intramolecular proton-transfer (ESIPT) scaffold

Chemical science (Cambridge), 2018, Vol.9 (10), p.2666-2673

2018

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Does Inactive Alkyl Chain Enhance Triplet–Triplet Annihilation of 9,10-Diphenylanthracene Derivatives?

Journal of physical chemistry. C, 2018-03, Vol.122 (10), p.5334-5340

2018

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Multiscale Simulations on Charge Transport in Covalent Organic Frameworks Including Dynamics of Transfer Integrals from the FMO-DFTB/LCMO Approach

Journal of physical chemistry. C, 2017-08, Vol.121 (33), p.17712-17726

2017

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Computational study on the roles of amino acid residues in the active site formation mechanism of blue-light photoreceptors

Chemical physics letters, 2015-07, Vol.633, p.247-251

2015

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Calculation of Charge-Transfer Electronic Coupling with Nonempirically Tuned Range-Separated Density Functional

Journal of physical chemistry. C, 2019-05, Vol.123 (18), p.11351-11361

2019

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A Strap Strategy for Construction of an Excited-State Intramolecular Proton Transfer (ESIPT) System with Dual Fluorescence

Angewandte Chemie, 2014-07, Vol.126 (31), p.8370-8374

2014

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2P250 Theoretical study of the electron transfer reaction by DNA photolyase(18A. Photobiology:Vision & Photoreception,Poster)

Seibutsu Butsuri, 2014/08/20, Vol.54(supplement1-2), pp.S236

2014

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Toward Accurate Prediction of Ion Mobility in Organic Semiconductors by Atomistic Simulation

Journal of chemical theory and computation, 2023-03, Vol.19 (5), p.1517-1528

2023

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Spectral changes of light-harvesting complex 2 lacking B800 bacteriochlorophyll a under neutral pH conditions

Photochemical & photobiological sciences, 2024-04

2024

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Comparison between the Light-Harvesting Mechanisms of Type‑I Photosynthetic Reaction Centers of Heliobacteria and Photosystem I: Pigment Site Energy Distribution and Exciton State

The journal of physical chemistry. B, 2021-04, Vol.125 (15), p.3727-3738

2021

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Excitonic Coupling on a Heliobacterial Symmetrical Type‑I Reaction Center: Comparison with Photosystem I

The journal of physical chemistry. B, 2020-01, Vol.124 (2), p.389-403

2020

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Experimental and Theoretical Mutation of Exciton States on the Smallest Type‑I Photosynthetic Reaction Center Complex of a Green Sulfur Bacterium Chlorobaclum tepidum

The journal of physical chemistry. B, 2024-01, Vol.128 (3), p.731-743

2024

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A copper() thiocyanate-based photoresponsive semiconducting 2D coordination polymer

Dalton transactions : an international journal of inorganic chemistry, 2024-01, Vol.53 (4), p.1445-1448

2024

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Tunneling matrix element and tunneling pathways of protein electron transfer calculated with a fragment molecular orbital method

The Journal of chemical physics, 2020-09, Vol.153 (10), p.104104-104104

2020

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Charge-transfer matrix elements by FMO-LCMO approach: Hole transfer in DNA with parameter tuned range-separated DFT

Chemical physics letters, 2015-02, Vol.621, p.96-101

2015

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Theoretical Model of the Far-Red-Light-Adapted Photosystem I Reaction Center of Cyanobacterium Acaryochloris marina Using Chlorophyll d and the Effect of Chlorophyll Exchange

The journal of physical chemistry. B, 2022-06, Vol.126 (22), p.4009-4021

2022

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Fragment Molecular Orbital Study on Electron Tunneling Mechanisms in Bacterial Photosynthetic Reaction Center

The journal of physical chemistry. B, 2012-11, Vol.116 (43), p.12933-12945

2012

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Near infrared two-photon-excited and -emissive dyes based on a strapped excited-state intramolecular proton-transfer (ESIPT) scaffoldElectronic supplementary information (ESI) available: Detailed synthetic protocols and characterization data of all new compounds, crystal structures of 3 and 6, photophysical properties of 2-7, details of theoretical calculations for 2 and 3, including Schemes S1-S6 and Fig. S1-S83, and X-ray crystallographic data for 3 (CCDC 1813601) and 6 (CCDC 1813602). For ESI

2018-03

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Limited solvation of an electron donating tryptophan stabilizes a photoinduced charge-separated state in plant (6-4) photolyase

A Strap Strategy for Construction of an Excited-State Intramolecular Proton Transfer (ESIPT) System with Dual Fluorescence

FMO3-LCMO study of electron transfer coupling matrix element and pathway: Application to hole transfer between two tryptophans through cis- and trans-polyproline-linker systems

Synergetic Effects of Triplet–Triplet Annihilation and Directional Triplet Exciton Migration in Organic Crystals for Photon Upconversion

Dynamical free energy based model for quantum decision making

Förster Resonance Energy Transfer between Fluorescent Proteins: Efficient Transition Charge-Based Study

Electron Transfer Pathways of Cyclobutane Pyrimidine Dimer Photolyase Revisited

Near infrared two-photon-excited and -emissive dyes based on a strapped excited-state intramolecular proton-transfer (ESIPT) scaffold

Does Inactive Alkyl Chain Enhance Triplet–Triplet Annihilation of 9,10-Diphenylanthracene Derivatives?

Multiscale Simulations on Charge Transport in Covalent Organic Frameworks Including Dynamics of Transfer Integrals from the FMO-DFTB/LCMO Approach

Computational study on the roles of amino acid residues in the active site formation mechanism of blue-light photoreceptors

Calculation of Charge-Transfer Electronic Coupling with Nonempirically Tuned Range-Separated Density Functional

A Strap Strategy for Construction of an Excited-State Intramolecular Proton Transfer (ESIPT) System with Dual Fluorescence

2P250 Theoretical study of the electron transfer reaction by DNA photolyase(18A. Photobiology:Vision & Photoreception,Poster)

Toward Accurate Prediction of Ion Mobility in Organic Semiconductors by Atomistic Simulation

Spectral changes of light-harvesting complex 2 lacking B800 bacteriochlorophyll a under neutral pH conditions

Comparison between the Light-Harvesting Mechanisms of Type‑I Photosynthetic Reaction Centers of Heliobacteria and Photosystem I: Pigment Site Energy Distribution and Exciton State

Excitonic Coupling on a Heliobacterial Symmetrical Type‑I Reaction Center: Comparison with Photosystem I

Experimental and Theoretical Mutation of Exciton States on the Smallest Type‑I Photosynthetic Reaction Center Complex of a Green Sulfur Bacterium Chlorobaclum tepidum

A copper() thiocyanate-based photoresponsive semiconducting 2D coordination polymer

Tunneling matrix element and tunneling pathways of protein electron transfer calculated with a fragment molecular orbital method

Charge-transfer matrix elements by FMO-LCMO approach: Hole transfer in DNA with parameter tuned range-separated DFT

Theoretical Model of the Far-Red-Light-Adapted Photosystem I Reaction Center of Cyanobacterium Acaryochloris marina Using Chlorophyll d and the Effect of Chlorophyll Exchange

Fragment Molecular Orbital Study on Electron Tunneling Mechanisms in Bacterial Photosynthetic Reaction Center

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