栗田典之 (Noriyuki Kurita) - マイポータル

基本情報

所属: 豊橋技術科学大学工学部情報・知能工学系准教授

学位: 博士(工学)(筑波大学)

J-GLOBAL ID: 200901082948125247
researchmap会員ID: 1000206904

外部リンク: http://www.klab.cs.tut.ac.jp

研究キーワード

研究分野

経歴

2007年4月 - 現在

豊橋技術科学大学情報・知能工学系准教授
2002年4月 - 2007年3月

豊橋技術科学大学工学部助教授
1996年7月 - 2002年3月

豊橋技術科学大学工学部助手
1996年 - 2002年

Lecturer, Toyohashi Univ. of Technology
2002年

- Associate Prof., Toyohashi Univ. of Technology
1989年4月 - 1996年6月

(株)日立製作所エネルギー研究所研究員
1989年 - 1996年

Researcher, Hitachi, Energy Research
Laboratory,

学歴

論文

210

FMO calculations for zinc metalloprotease: Fragmentation of amino-acid residues coordinated to zinc ion

Imai, K, Takimoto, D, Saito, R, Watanabe, C, Fukuzawa, K, Kurita, N

Chem-Bio Informatics Journal 22 21-25 2022年6月査読有り最終著者責任著者
Water molecule-mediated selective inhibition of bacterial zinc metalloproteinases by non-hydroxamate compounds: Ab initio molecular simulations

Saito, R, Imai, k, Takimoto, D, Ezawa, T, Sugiyama, S, Takimoto-Kamimura, M, Kurita, N

Journal of Molecular Graphics and Modelling in press 2022年6月査読有り最終著者責任著者
Proposal of selective inhibitor for bacterial zinc metalloprotease: Molecular mechanics and ab initio molecular orbital calculations

Imai, K, Saito, R, Ezawa, T, Sugiyama, S, Sylte, I, Kurita, N

Journal of Molecular Graphics and Modelling 110 108047 2022年1月査読有り最終著者責任著者
Specific interactions between the alkaline protease of P. aeruginosa and its natural peptide inhibitor: ab initio molecular simulations

Ryosuke Saito, Kyohei Imai, Shohei Yamamoto, Takuya Ezawa, Satoshi Sugiyama, Linn Samira Mari Evenseth, Ingebrigt Sylte, Noriyuki Kurita

Journal of Molecular Modeling 28(1) 2022年1月査読有り最終著者責任著者
Proposal of novel natural inhibitors of severe acute respiratory syndrome coronavirus 2 main protease: Molecular docking and ab initio fragment molecular orbital calculations

Divya Shaji, Shohei Yamamoto, Ryosuke Saito, Ryo Suzuki, Shunya Nakamura, Noriyuki Kurita

Biophysical Chemistry 275 106608-106608 2021年8月査読有り最終著者責任著者
Single-molecule junction spontaneously restored by DNA zipper

Harashima, T, Fujii, S, Jono, Y, Terakawa, T, Kurita, N, Kaneko, S, Kiguchi, M, Nishino, T

2021年6月
Proposal of novel potent inhibitors against androgen receptor based on ab initio molecular orbital calculations

Shunya Nakamura, Ryosuke Saito, Shohei Yamamoto, Ittetsu Kobayashi, Ryosuke Takeda, Rie Suzuki, Kentaro Kawai, Midori Takimoto-Kamimura, Noriyuki Kurita

Journal of Molecular Graphics and Modelling 105 107873-107873 2021年6月査読有り最終著者責任著者
Proposal of novel inhibitors for vitamin-D receptor: Molecular docking, molecular mechanics and ab initio molecular orbital simulations

Shunya Nakamura, Ryosuke Saito, Shohei Yamamoto, Yuta Terauchi, Atsushi Kittaka, Midori Takimoto-Kamimura, Noriyuki Kurita

Biophysical Chemistry 270 106540-106540 2021年3月査読有り最終著者責任著者
FMODB: The World’s First Database of Quantum Mechanical Calculations for Biomacromolecules Based on the Fragment Molecular Orbital Method

Daisuke Takaya, Chiduru Watanabe, Shunpei Nagase, Kikuko Kamisaka, Yoshio Okiyama, Hirotomo Moriwaki, Hitomi Yuki, Tomohiro Sato, Noriyuki Kurita, Yoichiro Yagi, Tatsuya Takagi, Norihito Kawashita, Kenichiro Takaba, Tomonaga Ozawa, Midori Takimoto-Kamimura, Shigenori Tanaka, Kaori Fukuzawa, Teruki Honma

Journal of Chemical Information and Modeling 61(2) 777-794 2021年2月22日査読有り
Proposal of Potent Inhibitors for a Bacterial Cell Division Protein FtsZ: Molecular Simulations Based on Molecular Docking and ab Initio Molecular Orbital Calculations

Shohei Yamamoto, Ryosuke Saito, Shunya Nakamura, Haruki Sogawa, Pavel Karpov, Sergey Shulga, Yaroslav Blume, Noriyuki Kurita

Antibiotics 9(12) 846-846 2020年11月26日査読有り最終著者責任著者
Design of galardine analogs as putative psudolysin inhibitors based on ab initio fragment molecular orbital calculations

Takuya Ezawa, Satoshi Sugiyama, Ayami Ara, Ingebrigt Sylte, Noriyuki Kurita

Journal of Biomolecular Structure and Dynamics 38(11) 3307-3317 2020年7月23日査読有り最終著者責任著者
Specific interactions between tau protein and curcumin derivatives: molecular docking and ab initio molecular orbital simulations

Sato, R, Vohra, S, Yamamoto, S, Suzuki, K, Karpov, P, Shulga, S, Blume, Y, Kurita, N

Journal of Molecular Graphics and Modelling 98 107611 2020年7月査読有り最終著者責任著者
Protonation states of amino acid residues in metallprotease complexed with its inhibitor: ab initio molecular simulations

Ezawa, T., Saito, R., Suzuki, S., Sugiyama, S., Sylte, I., Kurita, N.

Biophysical Chemistry 261 106368 2020年2月査読有り最終著者責任著者
Binding sites of Zantrin inhibitors to the bacterial cell division protein FtsZ: molecular docking and ab initio molecular orbital calculations

Sogawa, H, Sato, R, Suzuki, K, Tomioka, S, Shinzato, T, Karpov, P, Shulga, S, Blume, Y, Kurita, N

Chemical Physics 530 110603 2020年2月査読有り最終著者責任著者
Structural change of retinoic-acid receptor-related orphan receptor induced by binding of inverse-agonist: Molecular dynamics and ab initio molecular orbital simulations

Shusuke Suzuki, Toshiya Nakamura, Ryosuke Saito, Yuta Terauchi, Kentaro Kawai, Midori Takimoto-Kamimura, Noriyuki Kurita

Computational and Structural Biotechnology Journal 18 1676-1685 2020年査読有り最終著者責任著者
Proposal of therapeutic curcumin derivatives for Alzheimer’s disease based on ab initio molecular simulations

Shinzato, T, Sato, R, Suzuki, K, Tomioka, S, Sogawa, H, Shulga, S, Blume, Y, Kurita, N

Chemical Physics Letters 738 136883 2020年1月査読有り最終著者責任著者
Change in binding states between catabolite activating protein and DNA induced by ligand-binding: molecular dynamics and ab initio fragment molecular orbital calculations

Anan, R, Nakamura, T, Shimamura, K, Matsushita, Y, Ohyama, T, Kurita, N

Journal of Molecular Modeling 25 192-203 2019年6月査読有り最終著者責任著者
Specific interactions between 2-trans enoyl-acyl carrier protein reductase and its ligand: protein-ligand docking and ab initio fragment molecular orbital calculations

Phusi, N, Sato, R, Ezawa, T, Tomioka, S, Hanwarinroj, C, Khamsri, B, Kamsri, P, Punkvang, A, Pungpo, P, Kurita, N

Journal of Molecular Graphics and Modelling 88 299-308 2019年5月査読有り最終著者責任著者
Effect of Zn ion on the structure and electronic states of Aβ nonamer: molecular dynamics and ab initio molecular orbital calculations

Tomioka, S, Sogawa, H, Shinzato, T, Ishimura, H, Okamoto, A, Blume, Y, Shulga, S, Kurita, N

Molecular Simulation 45 706-715 2019年2月査読有り最終著者責任著者
Ligand chirality can affect histidine protonation of vitamin-D receptor: ab initio molecular orbital calculations in water

Terauchi, Y, Suzuki, R, Takeda, R, Kobayashi, I, Kittaka, A, Takimoto-Kamimura, M, Kurita, N

Journal of Steroid Biochemistry and Molecular Biology 186 89-95 2019年2月査読有り最終著者責任著者