重田 育照(シゲタ ヤステル)
- 査読付き学術雑誌・国際会議論文
- Structure and catalytic activity of a dihydrofolate reductase-like enzyme from Leptospira interrogans
Chandit Charin; Hengphasatporn Kowit; Donsuy Pattrapor...
INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES/298, 2025-04 - Apoprotein Intermolecular Interactions and Heme Insertion for 3D Domain Swapping in Myoglobin
Novientri Gissi; Takeda Koji; Duan Lian; Hengphasatpor...
ACS OMEGA/Epub, 2025-02-11 - Characterization of Delta-7 Alkenone Desaturase in Haptophyte Gephyrocapsa huxleyi Through Heterologous Expression in Tisochrysis lutea
Yoneda Kohei; Kobayashi Chinatsu; Araie Hiroya; Morita...
MARINE BIOTECHNOLOGY/27(1), 2025-02 - Polysulfur-based bulking of dynamin-related protein 1 prevents ischemic sulfide catabolism and heart failure in mice
Nishimura Akiyuki; Ogata Seiryo; Tang Xiaokang; Hengph...
NATURE COMMUNICATIONS/16(1), 2025-01-02 - GPNMB is a novel binding partner of FGFR1 that affects tumorigenic potential through AKT phosphorylation in TNBC
Elhinnawi Manar A.; Okita Yukari; Shigematsu Katsunobu...
CANCER SCIENCE/116(2)/pp.432-443, 2024-11-28 - Experimental and Computational Studies on Domain-Swapped Structure Stabilization of an Antibody Light Chain by Disulfide Bond Introduction
Fitriana Wahyu; Sakai Takahiro; Duan Lian; Hengphasatp...
JOURNAL OF MEDICINAL CHEMISTRY/67(24)/pp.22313-22321, 2024-12-10 - Enantioselective interactions of aminonitrile dimers
Watanabe Natsuki; Komatsu Yu; Miyagawa Koichi; Hori Y...
Physical chemistry chemical physics : PCCP/27(1)/pp.340-345, 2024-12-18 - Structural Fluctuation in Homodimeric Aminoacyl-tRNA Synthetases Induces Half-of-the-Sites Activity
Okamoto Yoshino; Yasuda Takunori; Morita Rikuri; Shige...
JOURNAL OF PHYSICAL CHEMISTRY B/128(44)/pp.10823-10830, 2024-10-23 - BEMM-GEN: A Toolkit for Generating a Biomolecular Environment-Mimicking Model for Molecular Dynamics Simulation
Yasuda Takunori; Morita Rikuri; Shigeta Yasuteru; Hara...
JOURNAL OF CHEMICAL INFORMATION AND MODELING/64(19)/pp.7184-7188, 2024-10-03 - A machine learning potential construction based on radial distribution function sampling
Watanabe Natsuki; Hori Yuta; Sugisawa Hiroki; Ida Tom...
JOURNAL OF COMPUTATIONAL CHEMISTRY/45(32)/p.2949, 2024-09-03 - Why is Dimeric 3D Domain Swapping in Antibody Light Chains Missing from the Solution? Atomistic Insights Mechanisms
Duan Lian; Hengphasatporn Kowit; Sakai Takahiro; Fujik...
JOURNAL OF PHYSICAL CHEMISTRY B/Epub, 2024-09-13 - Theoretical investigation of sustainable CO2 electroreduction to high-value products utilizing N-doped/BN-modified Triphenylene-Graphdiyne catalysts
Kongkaew Sirilak; Ratanasak Manussada; Shigeta Yasuter...
FUEL/379, 2025-01-01 - Design, Synthesis, and Biological Evaluation of Darunavir Analogs as HIV-1 Protease Inhibitors
Rehman Muhammad Asad Ur; Chuntakaruk Hathaichanok; Amph...
ACS BIO & MED CHEM AU/Epub, 2024-09-19 - Rational Design of Cyclopentadiene-Based Super- and Hyperacids Based on Aromaticity
Si Mrinal Kanti; Shigeta Yasuteru
JOURNAL OF PHYSICAL CHEMISTRY A/128(35)/pp.7384-7395, 2024-08-22 - シトクロムcの複合体形成過程の再現シミュレーション
下山紘充; 重田 育照
Journal of Computer Chemistry Japan/21(4)/pp.134-136, 2023-03 - 中分子の膜透過性に対する計算手法の検討
高橋 輝行; Kowit Hengphasatporn; 原田隆平; 重田 育照
Journal of Computer Chemistry, Japan/21(4)/pp.118-122, 2023-03 - Development interaction analysis of proteins based on machine learning method and application to Src tyrosine kinase
Yuta Yamamoto; 重田 育照
BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN/96(1)/pp.42-47, 2023-01 - Specific zinc binding to heliorhodopsin
Masanori Hashimoto; Koichi Miyagawa; Manish Singh; Kot...
Physical Chemistry Chemical Physics/25(4)/pp.3535-3543, 2023-01 - Real-time observation of a metal complex-driven reaction intermediate using a porous protein crystal and serial femtosecond crystallography
Maity Basudev; SHOJI Mitsuo; Luo Fangjia; Nakane Taka...
Nature communications/15(1)/p.5518, 2024-06 - Structural generation by inverse transformation using principal component analysis enhances conformational sampling of protein
MORITA Rikuri; SHIGETA Yasuteru; HARADA Ryuhei
Bulletein of Chemical Society of Japan/97(8)/p.uoae087, 2024-08-16 - Machine learning-based QSAR and LB-PaCS-MD guided design of SARS-CoV-2 main protease inhibitors
Toopradab Borwornlak; Xie Wanting; Duan Lian; Hengphas...
Bioorganic & medicinal chemistry letters/110, 2024-09-15 - Ribosome Tunnel Environment Drives the Formation of α-Helix during Cotranslational Folding
Yasuda Takunori; Morita Rikuri; Shigeta Yasuteru; Hara...
Journal of chemical information and modeling/64(16)/pp.6610-6622, 2024-08-26 - Calcium binding mechanism in TAT rhodopsin
Sugimoto Teppei; Miyagawa Koichi; SHOJI Mitsuo; Kataya...
The Journal of Physical Chemistry Part B/128(29)/pp.7102-7111, 2024-07 - Evaluating solubility, stability, and inclusion complexation of oxyresveratrol with various β-cyclodextrin derivatives using advanced computational techniques and experimental validation
Ali Saba; Aman Aamir; Hengphasatporn Kowit; Oopkaew L...
COMPUTATIONAL BIOLOGY AND CHEMISTRY/112, 2024-10 - Alpha and gamma mangostins inhibit wild-type B SARS-CoV-2 more effectively than the SARS-CoV-2 variants and the major target is unlikely the 3C-like protease
Suroengrit Aphinya; Cao Van; Wilasluck Patcharin; Deet...
HELIYON/10(11), 2024-06-15 - さらに表示...
- Structure and catalytic activity of a dihydrofolate reductase-like enzyme from Leptospira interrogans