Works by Shigeta, Yasuteru

Results: 115

Evaluations of Highly Stable Derivatives of Polycyanated Tricyclic[10]annulene Anions as Efficient Halogen‐Free Electrolyte for Lithium‐ and Sodium‐Ion Batteries.

Published in:

ChemPhysChem, 2025, v. 26, n. 11, p. 1, doi. 10.1002/cphc.202401109

By:

Si, Mrinal Kanti;
Hori, Yuta;
Shigeta, Yasuteru

Publication type:

Article

Front Cover: A Mild and Catalyst‐Free Synthesis of Cannabidiols and Regioisomers Mediated by Fluorinated Alcohols (Chem. Asian J. 12/2025).

Published in:

Chemistry - An Asian Journal, 2025, v. 20, n. 12, p. 1, doi. 10.1002/asia.202581201

By:

Yukhet, Phanomsak;
Faikhruea, Kriangsak;
Mowang, Rewadee;
Naweephattana, Phiphob;
Ratanasak, Manussada;
Shigeta, Yasuteru;
Rungrotmongkol, Thanyada;
Aonbangkhen, Chanat;
Vilaivan, Tirayut

Publication type:

Article

A Mild and Catalyst‐Free Synthesis of Cannabidiols and Regioisomers Mediated by Fluorinated Alcohols.

Published in:

Chemistry - An Asian Journal, 2025, v. 20, n. 12, p. 1, doi. 10.1002/asia.202401648

By:

Yukhet, Phanomsak;
Faikhruea, Kriangsak;
Mowang, Rewadee;
Naweephattana, Phiphob;
Ratanasak, Manussada;
Shigeta, Yasuteru;
Rungrotmongkol, Thanyada;
Aonbangkhen, Chanat;
Vilaivan, Tirayut

Publication type:

Article

The 8-bromobaicalein alleviated chikungunya-induced musculoskeletal inflammation and reduced the viral load in healthy adult mice.

Published in:

Emerging Microbes & Infections, 2023, v. 12, n. 2, p. 1, doi. 10.1080/22221751.2023.2270074

By:

Cao, Van;
Loeanurit, Naphat;
Hengphasatporn, Kowit;
Hairani, Rita;
Wacharachaisurapol, Noppadol;
Prompila, Nantaporn;
Wittayalertpanya, Supeecha;
Shigeta, Yasuteru;
Khotavivattana, Tanatorn;
Chavasiri, Warinthorn;
Boonyasuppayakorn, Siwaporn

Publication type:

Article

Publisher Correction: Unveiling the antiviral inhibitory activity of ebselen and ebsulfur derivatives on SARS-CoV-2 using machine learning-based QSAR, LB-PaCS-MD, and experimental assay.

Published in:

2025

By:

Sinsulpsiri, Silpsiri;
Nishii, Yuji;
Xu-Xu, Qing-Feng;
Miura, Masahiro;
Wilasluck, Patcharin;
Salamteh, Kanokwan;
Deetanya, Peerapon;
Wangkanont, Kittikhun;
Suroengrit, Aphinya;
Boonyasuppayakorn, Siwaporn;
Duan, Lian;
Harada, Ryuhei;
Hengphasatporn, Kowit;
Shigeta, Yasuteru;
Shi, Liyi;
Maitarad, Phornphimon;
Rungrotmongkol, Thanyada

Publication type:

Correction Notice

Identification of novel TMEM16A blockers through integrated virtual screening, molecular dynamics, and experimental studies.

Published in:

Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-99751-w

By:

Sangkhawasi, Mattanun;
Pitaktrakul, Wichuda;
Khumjiang, Rungtiwa;
Shigeta, Yasuteru;
Muanprasat, Chatchai;
Hengphasatporn, Kowit;
Rungrotmongkol, Thanyada

Publication type:

Article

Unveiling the antiviral inhibitory activity of ebselen and ebsulfur derivatives on SARS-CoV-2 using machine learning-based QSAR, LB-PaCS-MD, and experimental assay.

Published in:

Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-91235-1

By:

Sinsulpsiri, Silpsiri;
Nishii, Yuji;
Xu-Xu, Qing-Feng;
Miura, Masahiro;
Wilasluck, Patcharin;
Salamteh, Kanokwan;
Deetanya, Peerapon;
Wangkanont, Kittikhun;
Suroengrit, Aphinya;
Boonyasuppayakorn, Siwaporn;
Duan, Lian;
Harada, Ryuhei;
Hengphasatporn, Kowit;
Shigeta, Yasuteru;
Shi, Liyi;
Maitarad, Phornphimon;
Rungrotmongkol, Thanyada

Publication type:

Article

Polysulfur-based bulking of dynamin-related protein 1 prevents ischemic sulfide catabolism and heart failure in mice.

Published in:

Nature Communications, 2025, v. 16, p. 1, doi. 10.1038/s41467-024-55661-5

By:

Nishimura, Akiyuki;
Ogata, Seiryo;
Tang, Xiaokang;
Hengphasatporn, Kowit;
Umezawa, Keitaro;
Sanbo, Makoto;
Hirabayashi, Masumi;
Kato, Yuri;
Ibuki, Yuko;
Kumagai, Yoshito;
Kobayashi, Kenta;
Kanda, Yasunari;
Urano, Yasuteru;
Shigeta, Yasuteru;
Akaike, Takaaki;
Nishida, Motohiro

Publication type:

Article

In silico analysis of inhibitor intrusion into the AQP7 channel for efficient drug design.

Published in:

Chemistry Letters, 2025, v. 54, n. 4, p. 1, doi. 10.1093/chemle/upaf063

By:

Obata, Koryo;
Shigeta, Yasuteru;
Harada, Ryuhei

Publication type:

Article

Assessment of the applicability of the LFC/3D-RISM-SCF scheme for pKa prediction in methanol solutions.

Published in:

Chemistry Letters, 2024, v. 53, n. 1, p. 1, doi. 10.1093/chemle/upad009

By:

Ryo Fujiki;
Toru Matsui;
Yasuteru Shigeta;
Norio Yoshida;
Haruyuki Nakano

Publication type:

Article

Evaluation of an Appropriate Standard Hydrogen Electrode Potential for Computing Redox Potentials of Catechins with Density Functional Theory.

Published in:

Chemistry Letters, 2022, v. 51, n. 7, p. 673, doi. 10.1246/cl.220165

By:

Lian Duan;
Yu Takan;
Yasuteru Shigeta

Publication type:

Article

Integrated In Silico Studies on the Role of Nicotinamide Adenine Dinucleotide (NADH) Binding in Activating C-Terminal Binding Protein 2 (CtBP2).

Published in:

Chemistry Letters, 2022, v. 51, n. 1, p. 1, doi. 10.1246/cl.210548

By:

Tsukasa Aoyagi;
Ryunosuke Yoshino;
Yuki Mitsuta;
Rikuri Morita;
Ryuhei Harada;
Yasuteru Shigeta

Publication type:

Article

Molecular Motions of Imidazole in Poly(vinylphosphonic acid)-Imidazole Composites Investigated by Molecular Dynamics Simulations.

Published in:

Chemistry Letters, 2021, v. 50, n. 1, p. 17, doi. 10.1246/cl.200635

By:

Yuta Hori;
Toshiya Suetake;
Yasuteru Shigeta;
Tomonori Ida;
Motohiro Mizuno

Publication type:

Article

Distribution of Counter Ions in Negatively-charged Lipid/Water/Air Interface: Molecular Dynamics Study.

Published in:

Chemistry Letters, 2020, v. 49, n. 4, p. 361, doi. 10.1246/cl.200043

By:

Teruyuki Takahashi;
Ryuhei Harada;
Yasuteru Shigeta

Publication type:

Article

Possible Configurations of Apo-form Taste Receptor Type 1 (T1r) Studied by Microsecond-order Molecular Dynamics Simulation.

Published in:

Chemistry Letters, 2019, v. 48, n. 4, p. 325, doi. 10.1246/cl.181030

By:

Hayato Aida;
Ryuhei Harada;
Yasuteru Shigeta

Publication type:

Article

Effects of Antifreezing Protein from Rhagium inquisitor Binding on Ice Growth: A Molecular Dynamics Study.

Published in:

Chemistry Letters, 2019, v. 48, n. 3, p. 223, doi. 10.1246/cl.180963

By:

Masato Kimatsuka;
Ryuma Sato;
Ryuhei Harada;
Mitsuo Shoji;
Yasuteru Shigeta

Publication type:

Article

DFT Analysis of Low-frequency Heme Vibrations in Soluble Guanylate Cyclase: Raman Mode Enhancement by Propionate-Protein Interactions.

Published in:

Chemistry Letters, 2012, v. 41, n. 9, p. 860, doi. 10.1246/cl.2012.860

By:

Minoru Kubo;
Orio Okuyama;
Teizo Kitagawa;
Yasuteru Shigeta

Publication type:

Article

Mutations affecting the internal equilibrium of the reaction catalyzed by 6-aminohexanoate-dimer hydrolase.

Published in:

FEBS Letters, 2016, v. 590, n. 18, p. 3133, doi. 10.1002/1873-3468.12354

By:

Negoro, Seiji;
Kawashima, Yasuyuki;
Shibata, Naoki;
Kobayashi, Tatsuya;
Baba, Takeshi;
Lee, Young-Ho;
Kamiya, Katsumasa;
Shigeta, Yasuteru;
Nagai, Keisuke;
Takehara, Ikki;
Kato, Dai-ichiro;
Takeo, Masahiro;
Higuchi, Yoshiki

Publication type:

Article

A machine learning potential construction based on radial distribution function sampling.

Published in:

Journal of Computational Chemistry, 2024, v. 45, n. 32, p. 2949, doi. 10.1002/jcc.27497

By:

Watanabe, Natsuki;
Hori, Yuta;
Sugisawa, Hiroki;
Ida, Tomonori;
Shoji, Mitsuo;
Shigeta, Yasuteru

Publication type:

Article

Molecular Dynamics Simulation of the Nanoscale Solutal Marangoni Convection.

Published in:

ASEAN Journal of Chemical Engineering, 2017, v. 17, n. 1, p. 29

By:

Yosuke Imai;
Takuya Yamamoto;
Yasunori Okano;
Ryuma Sato;
Yasuteru Shigeta

Publication type:

Article

Binding of a Positron to Nucleic Base Molecules and Their Pairs.

Published in:

ChemPhysChem, 2013, v. 14, n. 15, p. 3458, doi. 10.1002/cphc.201300549

By:

Koyanagi, Katsuhiko;
Kita, Yukiumi;
Shigeta, Yasuteru;
Tachikawa, Masanori

Publication type:

Article

Open-Shell Characters and Second Hyperpolarizabilities of One-Dimensional Graphene Nanoflakes Composed of Trigonal Graphene Units.

Published in:

ChemPhysChem, 2011, v. 12, n. 9, p. 1697, doi. 10.1002/cphc.201001089

By:

Yoneda, Kyohei;
Nakano, Masayoshi;
Fukui, Hitoshi;
Minami, Takuya;
Shigeta, Yasuteru;
Kubo, Takashi;
Botek, Edith;
Champagne, Benoît

Publication type:

Article

Mechanistic Insight into Weak Base-Catalyzed Generation of Carbon Monoxide from Phenyl Formate and Its Application to Catalytic Carbonylation at Room Temperature without Use of External Carbon Monoxide Gas.

Published in:

Advanced Synthesis & Catalysis, 2017, v. 359, n. 20, p. 3592, doi. 10.1002/adsc.201700751

By:

Konishi, Hideyuki;
Matsubara, Mika;
Mori, Keisuke;
Tokiwa, Takaki;
Arulmozhiraja, Sundaram;
Yamamoto, Yuta;
Ishikawa, Yoshinobu;
Hashimoto, Hiroshi;
Shigeta, Yasuteru;
Tokiwa, Hiroaki;
Manabe, Kei

Publication type:

Article

Unlocking E‐arylidene Steroid Derivatives as Promising α‐Glucosidase Inhibitors.

Published in:

ChemistrySelect, 2024, v. 9, n. 9, p. 1, doi. 10.1002/slct.202303887

By:

Danova, Ade;
Pattanapanyasat, Kovit;
Hengphasatporn, Kowit;
Shigeta, Yasuteru;
Rungrotmongkol, Thanyada;
Hermawati, Elvira;
Chavasiri, Warinthorn

Publication type:

Article

An assessment of optimal time scale of conformational resampling for parallel cascade selection molecular dynamics.

Published in:

Molecular Simulation, 2018, v. 44, n. 3, p. 206, doi. 10.1080/08927022.2017.1362696

By:

Harada, Ryuhei;
Shigeta, Yasuteru

Publication type:

Article

Classical cumulant dynamics for statistical chemical physics.

Published in:

Molecular Simulation, 2017, v. 43, n. 13, p. 1260, doi. 10.1080/08927022.2017.1315770

By:

Yasuteru Shigeta;
Ryuhei Harada;
Ryuma Sato;
Hirotaka Kitoh-Nishioka;
Thi Kieu My Bui;
Akimasa Sato;
Takaki Tokiwa;
Akane Kyan;
Yuki Ishii;
Masato Kimatsuka;
Sotaro Yamasaki;
Megumi Kayanuma;
Mitsuo Shoji

Publication type:

Article

Author Correction: The 8-bromobaicalein inhibited the replication of dengue, and Zika viruses and targeted the dengue polymerase.

Published in:

2023

By:

Boonyasuppayakorn, Siwaporn;
Saelee, Thanaphon;
Huynh, Thao Nguyen Thanh;
Hairani, Rita;
Hengphasatporn, Kowit;
Loeanurit, Naphat;
Cao, Van;
Vibulakhaophan, Vipanee;
Siripitakpong, Panattida;
Kaur, Parveen;
Chu, Justin Jang Hann;
Tunghirun, Chairat;
Choksupmanee, Opas;
Chimnaronk, Sarin;
Shigeta, Yasuteru;
Rungrotmongkol, Thanyada;
Chavasiri, Warinthorn

Publication type:

Correction Notice

The 8-bromobaicalein inhibited the replication of dengue, and Zika viruses and targeted the dengue polymerase.

Published in:

Scientific Reports, 2023, v. 13, n. 1, p. 1, doi. 10.1038/s41598-023-32049-x

By:

Boonyasuppayakorn, Siwaporn;
Saelee, Thanaphon;
Huynh, Thao Nguyen Thanh;
Hairani, Rita;
Hengphasatporn, Kowit;
Loeanurit, Naphat;
Cao, Van;
Vibulakhaophan, Vipanee;
Siripitakpong, Panattida;
Kaur, Parveen;
Chu, Justin Jang Hann;
Tunghirun, Chairat;
Choksupmanee, Opas;
Chimnaronk, Sarin;
Shigeta, Yasuteru;
Rungrotmongkol, Thanyada;
Chavasiri, Warinthorn

Publication type:

Article

The 8-bromobaicalein inhibited the replication of dengue, and Zika viruses and targeted the dengue polymerase.

Published in:

Scientific Reports, 2023, v. 13, n. 1, p. 1, doi. 10.1038/s41598-023-32049-x

By:

Boonyasuppayakorn, Siwaporn;
Saelee, Thanaphon;
Huynh, Thao Nguyen Thanh;
Hairani, Rita;
Hengphasatporn, Kowit;
Loeanurit, Naphat;
Cao, Van;
Vibulakhaophan, Vipanee;
Siripitakpong, Panattida;
Kaur, Parveen;
Chu, Justin Jang Hann;
Tunghirun, Chairat;
Choksupmanee, Opas;
Chimnaronk, Sarin;
Shigeta, Yasuteru;
Rungrotmongkol, Thanyada;
Chavasiri, Warinthorn

Publication type:

Article

Design, synthesis, in vitro, in silico, and SAR studies of flavone analogs towards anti-dengue activity.

Published in:

Scientific Reports, 2022, v. 12, n. 1, p. 1, doi. 10.1038/s41598-022-25836-5

By:

Patigo, Apinya;
Hengphasatporn, Kowit;
Cao, Van;
Paunrat, Wattamon;
Vijara, Natthanan;
Chokmahasarn, Thamonwan;
Maitarad, Phornphimon;
Rungrotmongkol, Thanyada;
Shigeta, Yasuteru;
Boonyasuppayakorn, Siwaporn;
Khotavivattana, Tanatorn

Publication type:

Article

Autism-associated mutation in Hevin/Sparcl1 induces endoplasmic reticulum stress through structural instability.

Published in:

Scientific Reports, 2022, v. 12, n. 1, p. 1, doi. 10.1038/s41598-022-15784-5

By:

Taketomi, Takumi;
Yasuda, Takunori;
Morita, Rikuri;
Kim, Jaehyun;
Shigeta, Yasuteru;
Eroglu, Cagla;
Harada, Ryuhei;
Tsuruta, Fuminori

Publication type:

Article

A Free-Energy Landscape Analysis of Calmodulin Obtained from an NMR Data-Utilized Multi-Scale Divide-and-Conquer Molecular Dynamics Simulation.

Published in:

Life (2075-1729), 2021, v. 11, n. 11, p. 1241, doi. 10.3390/life11111241

By:

Shimoyama, Hiromitsu;
Shigeta, Yasuteru

Publication type:

Article

Hydration effects on enzyme–substrate complex of nylon oligomer hydrolase: inter-fragment interaction energy study by the fragment molecular orbital method.

Published in:

Molecular Physics, 2015, v. 113, n. 3/4, p. 319, doi. 10.1080/00268976.2014.941311

By:

Ando, Hiroyuki;
Shigeta, Yasuteru;
Baba, Takeshi;
Watanabe, Chiduru;
Okiyama, Yoshio;
Mochizuki, Yuji;
Nakano, Masayoshi

Publication type:

Article

Substitution effects on optical properties of iminonitroxide- substituted iminonitroxide diradical.

Published in:

Molecular Physics, 2015, v. 113, n. 3/4, p. 267, doi. 10.1080/00268976.2014.937777

By:

Nakamura, Ryota;
Shigeta, Yasuteru;
Okuno, Katsuki;
Hasegawa, Miki;
Fukushima, Mayuko;
Suzuki, Shuichi;
Kozaki, Masatoshi;
Okada, Keiji;
Nakano, Masayoshi

Publication type:

Article

Residue Folding Degree—Relationship to Secondary Structure Categories and Use as Collective Variable.

Published in:

International Journal of Molecular Sciences, 2021, v. 22, n. 23, p. 13042, doi. 10.3390/ijms222313042

By:

Sladek, Vladimir;
Harada, Ryuhei;
Shigeta, Yasuteru

Publication type:

Article

Structural generation by inverse transformation using principal component analysis enhances conformational sampling of protein.

Published in:

Bulletin of the Chemical Society of Japan, 2024, v. 97, n. 8, p. 1, doi. 10.1093/bulcsj/uoae087

By:

Rikuri Morita;
Yasuteru Shigeta;
Ryuhei Harada

Publication type:

Article

Theoretical study on molecular charge populations of 1D π-stacked multimers in neutral and electron oxidation states.

Published in:

Bulletin of the Chemical Society of Japan, 2024, v. 97, n. 3, p. 1, doi. 10.1093/bulcsj/uoae009

By:

Wataru Yoshida;
Yasuteru Shigeta;
Hiroshi Matsui;
Hajime Miyamoto;
Ryohei Kishi;
Yasutaka Kitagawa

Publication type:

Article

A Practical Prediction of LogPo/w through Semiempirical Electronic Structure Calculations with Dielectric Continuum Model.

Published in:

Bulletin of the Chemical Society of Japan, 2021, v. 94, n. 7, p. 1807, doi. 10.1246/bcsj.20210035

By:

Teruyuki Takahashi;
Toru Matsui;
Kowit Hengphasatporn;
Yasuteru Shigeta

Publication type:

Article

A Practical Approach for Searching Stable Molecular Structures by Introducing Repulsive Interactions among Walkers.

Published in:

Bulletin of the Chemical Society of Japan, 2018, v. 91, n. 10, p. 1465, doi. 10.1246/bcsj.20180122

By:

Mitsuo Shoji;
Megumi Kayanuma;
Yasuteru Shigeta

Publication type:

Article

Development of an FeII Complex Exhibiting Intermolecular Proton Shifting Coupled Spin Transition.

Published in:

Angewandte Chemie International Edition, 2024, v. 63, n. 25, p. 1, doi. 10.1002/anie.202404843

By:

Ji, Tianchi;
Su, Shengqun;
Wu, Shuqi;
Hori, Yuta;
Shigeta, Yasuteru;
Huang, Yubo;
Zheng, Wenwei;
Xu, Wenhuang;
Zhang, Xiaopeng;
Kiyanagi, Ryoji;
Munakata, Koji;
Ohhara, Takashi;
Nakanishi, Takumi;
Sato, Osamu

Publication type:

Article

New assay method based on Raman spectroscopy for enzymes reacting with gaseous substrates.

Published in:

Protein Science: A Publication of the Protein Society, 2019, v. 28, n. 3, p. 663, doi. 10.1002/pro.3569

By:

Kawahara‐Nakagawa, Yuka;
Nishikawa, Koji;
Nakashima, Satoru;
Inoue, Shota;
Ohta, Takehiro;
Ogura, Takashi;
Shigeta, Yasuteru;
Fukutani, Katsuyuki;
Yagi, Tatsuhiko;
Higuchi, Yoshiki

Publication type:

Article

Corrigendum: Chirality without Stereoisomers: Insight from the Helical Response of Bond Electrons.

Published in:

ChemPhysChem, 2022, v. 23, n. 5, p. 1, doi. 10.1002/cphc.202200032

By:

Xu, Tianlv;
Nie, Xing;
Li, Shuman;
Yang, Yong;
Früchtl, Herbert;
van Mourik, Tanja;
Kirk, Steven R.;
Paterson, Martin J.;
Shigeta, Yasuteru;
Jenkins, Samantha

Publication type:

Article

Chirality without Stereoisomers: Insight from the Helical Response of Bond Electrons.

Published in:

ChemPhysChem, 2021, v. 22, n. 19, p. 1989, doi. 10.1002/cphc.202100397

By:

Xu, Tianlv;
Nie, Xing;
Li, Shuman;
Yang, Yong;
Früchtl, Herbert;
van Mourik, Tanja;
Kirk, Steven R.;
Paterson, Martin J.;
Shigeta, Yasuteru;
Jenkins, Samantha

Publication type:

Article

Development of an FeII Complex Exhibiting Intermolecular Proton Shifting Coupled Spin Transition.

Published in:

Angewandte Chemie, 2024, v. 136, n. 25, p. 1, doi. 10.1002/ange.202404843

By:

Ji, Tianchi;
Su, Shengqun;
Wu, Shuqi;
Hori, Yuta;
Shigeta, Yasuteru;
Huang, Yubo;
Zheng, Wenwei;
Xu, Wenhuang;
Zhang, Xiaopeng;
Kiyanagi, Ryoji;
Munakata, Koji;
Ohhara, Takashi;
Nakanishi, Takumi;
Sato, Osamu

Publication type:

Article

Reaction of threonine synthase with the substrate analogue 2-amino-5-phosphonopentanoate: implications into the proton transfer at the active site.

Published in:

Journal of Biochemistry, 2020, v. 167, n. 4, p. 357, doi. 10.1093/jb/mvz100

By:

Machida, Yasuhiro;
Murakawa, Takeshi;
Sakai, Akiko;
Shoji, Mitsuo;
Shigeta, Yasuteru;
Hayashi, Hideyuki

Publication type:

Article

Protein folding pathways extracted by OFLOOD: Outlier FLOODing method.

Published in:

Journal of Computational Chemistry, 2015, v. 36, n. 2, p. 97, doi. 10.1002/jcc.23773

By:

Harada, Ryuhei;
Nakamura, Tomotake;
Takano, Yu;
Shigeta, Yasuteru

Publication type:

Article

On the induced-fit mechanism of substrate-enzyme binding structures of nylon-oligomer hydrolase.

Published in:

Journal of Computational Chemistry, 2014, v. 35, n. 16, p. 1240, doi. 10.1002/jcc.23614

By:

Baba, Takeshi;
Harada, Ryuhei;
Nakano, Masayoshi;
Shigeta, Yasuteru

Publication type:

Article

Finite-Field Method with Unbiased Polarizable Continuum Model for Evaluation of the Second Hyperpolarizability of an Open-Shell Singlet Molecule in Solvents.

Published in:

Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2345, doi. 10.1002/jcc.23395

By:

Inui, Tomoya;
Shigeta, Yasuteru;
Okuno, Katsuki;
Baba, Takeshi;
Kishi, Ryohei;
Nakano, Masayoshi

Publication type:

Article

Consistent Scheme for Computing Standard Hydrogen Electrode and Redox Potentials.

Published in:

Journal of Computational Chemistry, 2013, v. 34, n. 1, p. 21, doi. 10.1002/jcc.23100

By:

Matsui, Toru;
Kitagawa, Yasutaka;
Okumura, Mitsutaka;
Shigeta, Yasuteru;
Sakaki, Shigeyoshi

Publication type:

Article

Consistent scheme for computing standard hydrogen electrode and redox potentials.

Published in:

Journal of Computational Chemistry, 2013, v. 34, n. 1, p. 21, doi. 10.1002/jcc.23100

By:

Matsui, Toru;
Kitagawa, Yasutaka;
Okumura, Mitsutaka;
Shigeta, Yasuteru;
Sakaki, Shigeyoshi

Publication type:

Article