Zobrazeno 1 - 10
of 39
pro vyhledávání: '"Yoshiteru, Yonetani"'
Publikováno v:
AIP Advances, Vol 14, Iss 10, Pp 105318-105318-7 (2024)
Exposure of water to ionizing radiation induces OH radical formation. Within cellular environments, the presence of OH radicals can stimulate the abstraction of hydrogen atoms from the sugar backbone of DNA. Subsequent damage to DNA structures leads
Externí odkaz:
https://doaj.org/article/ebfff8489cb0436c86fabaee04a4f639
Autor:
Yoshiteru, Yonetani
Publikováno v:
日本放射線化学会 会誌「放射線化学」. 112:21-25
Water has a non-negligible contribution to the radiation damage of DNA; however, many parts of the microscopic relationship still remain unclear. This article reviews our recent study in which we explore the microscopic behaviors of water and OH radi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=jairo_______::4c9be166c1d9ee648a0b74848796d3d9
https://repo.qst.go.jp/records/83726
https://repo.qst.go.jp/records/83726
Autor:
Yoshiteru Yonetani
Publikováno v:
Chemical Physics. 570:111860
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d5adc867b759079b32cecb74968e90f4
https://doi.org/10.1016/j.chemphys.2023.111860
https://doi.org/10.1016/j.chemphys.2023.111860
Autor:
Yoshiteru, Yonetani, Motoyasu, Adachi
Publikováno v:
分子シミュレーション学会 会誌アンサンブル. 23(3):182-187
蛋白質からリガンドが解離する際，リガンドが結合していた場所は水分子に置き換わる．そのため，リガンド解離において水分子が関係していることは確かである．しかし，リガンド解
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=jairo_______::14ce0de16c4701a1ccd2f49d01d2d9cc
https://repo.qst.go.jp/records/83001
https://repo.qst.go.jp/records/83001
Autor:
Yoshiteru, Yonetani
Publikováno v:
日本シミュレーション学会論文誌. 13(1):32-36
ヒトDNA中の軽水素がトリチウムに置換すると、壊変効果によりDNAが損傷する可能性がある。本研究では、トリチウム置換しやすい場所を特定するためヒトDNAのテロメア構造を対象に、そ
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=jairo_______::0a2a02bad5e7778582942f11d4992069
https://repo.qst.go.jp/records/82761
https://repo.qst.go.jp/records/82761
Autor:
Yoshiteru Yonetani
Publikováno v:
Chemical Physics Letters. 817:140406
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4680fa30f3c9436737f1df74e3d1c32d
https://doi.org/10.1016/j.cplett.2023.140406
https://doi.org/10.1016/j.cplett.2023.140406
Autor:
Mikio Kataoka, Hiroshi Nakagawa, Yasuhiro Inamura, Seiko Ohira-Kawamura, Kenji Nakajima, Tatsuya Kikuchi, Hidetoshi Kono, Yoshiteru Yonetani
Publikováno v:
Proceedings of the 3rd J-PARC Symposium (J-PARC2019).
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::877a0c90461fbbc5a0fd08482dc3f691
https://doi.org/10.7566/jpscp.33.011101
https://doi.org/10.7566/jpscp.33.011101
Autor:
Yoshiteru Yonetani
Publikováno v:
The Journal of chemical physics. 154(4)
Electrostatic interaction is long ranged; thus, the accurate calculation is not an easy task in molecular dynamics or Monte Carlo simulations. Though the rigorous Ewald method based on the reciprocal space has been established, real-space treatments
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::071a629ad5ce4bdb98335187d280baf1
https://pubmed.ncbi.nlm.nih.gov/33514106
https://pubmed.ncbi.nlm.nih.gov/33514106
Publikováno v:
Journal of Computational Chemistry. 39:1835-1842
We performed reaction path search calculations for the NaCl·(H2 O)6 cluster using the global reaction route mapping (GRRM) code to understand the atomic-level mechanisms of the NaCl → Na+ + Cl- ionic dissociation induced by water solvents. Low-lyi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4a669c2fbdc2328576d291266b5acb54
https://doi.org/10.1002/jcc.25227
https://doi.org/10.1002/jcc.25227
Autor:
Yoshiteru Yonetani
Publikováno v:
Molecular Physics. 115:2987-2998
Water-mediated ion-pair dissociation is studied by molecular dynamics simulations of NaCl in water. Multidimensional free-energy analysis clarifies the relation between two essential solvent coordi...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9685d7c27148ccaa48dc51493c6dbd1b
https://doi.org/10.1080/00268976.2017.1342006
https://doi.org/10.1080/00268976.2017.1342006