Hokkaido University Institute for Chemical Reaction Design and Discovery

2023年

• An Automated Reaction Route Mapping for the Reaction of NO and Active Species on Ag-4 Clusters in Zeolites
  S. Yasumura, T. Kato, T. Toyao, Z. Maeno, K. Shimizu, Phys. Chem. Chem. Phys., 2023, 12,
  DOI: 10.1039/d2cp04761f
  
• Multidynamic Crystalline Molecular Rotors Comprising an N-Heterocyclic Carbene Binuclear Au(I) Complex Bearing Multiple Rotators
  M. G. Jin, S. Matsuura, H. Yamamoto, M. Mizuno, H. Ito, European Journal of Organic Chemistry, 2023, 26, 12,
  DOI: 10.1002/ejoc.202201468
  
• Real-Time Observation of the Woodward-Hoffmann Rule for 1,3-Cyclohexadiene by Femtosecond Soft X-Ray Transient Absorption
  T. Sekikawa, N. Saito, Y. Kurimoto, N. Ishii, T. Mizuno, T. Kanai, J. Itatani, K. Saita, T. Taketsugu, Phys. Chem. Chem. Phys., 2023, ,
  DOI: 10.1039/d2cp05268g
  
• Chiral Calix 3 Pyrrole Derivatives: Synthesis, Racemization Kinetics, and Ring Expansion to Calix 9 - and Calix 12 Pyrrole Analogues
  Y. Inaba, J. Yang, Y. Kakibayashi, T. Yoneda, Y. Ide, Y. Hijikata, J. Pirillo, R. Saha, J. L. Sessler, Y. Inokuma, Angew. Chem., Int. Ed., 2023, ,
  DOI: 10.1002/anie.202301460
  
• Elasticity of Slide-Ring Gels
  D. Y. Chen, S. Panyukov, L. Sapir, M. Rubinstein, ACS Macro Lett., 2023, 12, 3, 362–368
  DOI: 10.1021/acsmacrolett.3c00010
  
• Combination Therapy with Bevacizumab and a CCR2 Inhibitor for Human Ovarian Cancer: An in Vivo Validation Study
  T. Y. Zhai, T. Mitamura, L. Wang, S. I. Kubota, M. Murakami, S. Tanaka, H. Watari, Cancer Medicine, 2023, ,
  DOI: 10.1002/cam4.5674
  
• Red-Light Photoswitching of Indigos in Polymer Thin Films
  K. Kuntze, J. Viljakka, M. Virkki, C. Y. Huang, S. Hecht, A. Priimagi, Chem. Sci., 2023, ,
  DOI: 10.1039/d2sc06790k
  
• Metal-Coordinated Dynamics and Viscoelastic Properties of Double-Network Hydrogels
  S. L. Zhu, Y. Wang, Z. Wang, L. Chen, F. B. Zhu, Y. A. Ye, Y. Zheng, W. W. Yu, Q. Zheng, Gels, 2023, 9(2), 145
  DOI: 10.3390/gels9020145
  
• Enhanced Rupture Force in a Cut-Dispersed Double-Network Hydrogel
  S. L. Zhu, D. D. Yan, L. Chen, Y. Wang, F. B. Zhu, Y. A. Ye, Y. Zheng, W. W. Yu, Q. Zheng, Gels, 2023, 9(2), 158
  DOI: 10.3390/gels9020158
  
• Photoredox/HAT-Catalyzed Dearomative Nucleophilic Addition of the CO2 Radical Anion to (Hetero)Aromatics
  S. R. Mangaonkar, H. Hayashi, H. Takano, W. Kanna, S. Maeda, T. Mita, Acs Catalysis, 2023, 13, 4, 2482-2488
  DOI: 10.1021/acscatal.2c06192
  
• Bright Lanthanide(III) Triboluminescence Despite Low Photoluminescence, and Dual Triboluminescence and Mechano-Responsive Photoluminescence
  Y. Hirai, S. Van Baaren, T. Ohmura, T. Nakanishi, T. Takeda, Y. Kitagawa, Y. Hasegawa, R. Metivier, C. Allain, Advanced Optical Materials, 2023, ,
  DOI: 10.1002/adom.202203139
  
• Luminescent Lanthanide Complexes for Effective Oxygen-Sensing and Singlet Oxygen Generation
  Y. Kitagawa, T. Nakai, S. Hosoya, S. Shoji, Y. Hasegawa, ChemPlusChem, 2023, ,
  DOI: 10.1002/cplu.202200445
  
• A Switchable System between Magnetic and Natural Circularly Polarised Luminescence via J-Aggregation Using Photosynthetic Antenna Model Compounds
  T. Tomikawa, Y. Kitagawa, K. Yoshioka, K. Murata, T. Miyatake, Y. Hasegawa, K. Ishii, J. Mater. Chem. C, 2023, 11,
  DOI: 10.1039/d2tc04841h
  
• A Novel pH-Dependent Sensor for Recognition of Strontium Ions in Water: A Hierarchically Structured Mesoporous Architectonics
  I. G. Alhindawy, D. A. Tolan, E. A. Elshehy, W. A. El-Said, S. M. Abdelwahab, H. I. Mira, T. Taketsugu, V. P. Utgikar, A. M. El-Nahas, A. O. Youssef, Talanta, 2023, 253,
  DOI: 10.1016/j.talanta.2022.124064
  
• One-Handed Helical Tubular Ladder Polymers for Chromatographic Enantioseparation
  W. Zheng, K. Oki, R. Saha, Y. Hijikata, E. Yashima, T. Ikai, Angew. Chem., Int. Ed., 2023, ,
  DOI: 10.1002/anie.202218297
  
• Predicting Highly Enantioselective Catalysts Using Tunable Fragment Descriptors
  N. Tsuji, P. Sidorov, C. D. Zhu, Y. Nagata, T. Gimadiev, A. Varnek, B. List, Angew. Chem., Int. Ed., 2023, ,
  DOI: 10.1002/anie.202218659
  
• Nickel-Catalyzed Asymmetric Allylic Alkylation of Beta-Dicarbonyl Compounds via C-C Bond Activation of 2-Allylated Cyclic 1,3-Diketones
  K. Higashida, V. Smail, H. Nagae, J. F. Carpentier, K. Mashima, Acs Catalysis, 2023, 13, 3, 2156-2161
  DOI: 10.1021/acscatal.2c05664
  
• Controlled Molecular Assemblies of Chiral Boron Dipyrromethene Derivatives for Circularly Polarized Luminescence in the Red and Near-Infrared Regions
  H. Sakai, Y. Suzuki, M. Tsurui, Y. Kitagawa, T. Nakashima, T. Kawai, Y. Kondo, G. Matsuba, Y. Hasegawa, T. Hasobe, J. Mater. Chem. C, 2023, ,
  DOI: 10.1039/d2tc05006d
  
• TEtraQuinolines: A Missing Link in the Family of Porphyrinoid Macrocycles
  W. Xu, Y. Nagata, N. Kumagai, J. Am. Chem. Soc., 2023, 145, 4, 2609–2618
  DOI: 10.1021/jacs.2c12582
  
• Exploring the Quantum Chemical Energy Landscape with GNN- Guided Artificial Force
  A. Nakao, Y. Harabuchi, S. Maeda, K. Tsuda, J. Chem. Theory Comput., 2023, 19, 3, 713–717
  DOI: 10.1021/acs.jctc.2c01061
  
• Divide-and-Conquer Linear-Scaling Quantum Chemical Computations
  H. Nakai, M. Kobayashi, T. Yoshikawa, J. Seino, Y. Ikabata, Y. Nishimura, J. Phys. Chem. A, 2023, 127, 3, 589–618
  DOI: 10.1021/acs.jpca.2c06965
  
• Load Transfer between Permanent and Dynamic Networks Due to Stress Gradients in Nonlinear Viscoelastic Hydrogels
  J. K. Wang, K. P. Cui, B. G. Zhu, J. P. Gong, C. Y. Hui, A. T. Zehnder, Extreme Mechanics Letters, 2023, 58,
  DOI: 10.1016/j.eml.2022.101928
  
• Squid/synthetic Polymer Double-Network Gel: Elaborated Anisotropy and Outstanding Fracture Toughness Characteristics
  S. Ohmura, T. Nakajima, M. Yoshida, J. P. Gong, Npg Asia Materials, 2023, 15, Article number: 2
  DOI: 10.1038/s41427-022-00454-9
  
• Boron-Catalyzed Alpha-Functionalizations of Carboxylic Acids
  Y. Shimizu, M. Kanai, Chemical Record, 2023, ,
  DOI: 10.1002/tcr.202200273
  
• Early-Stage Formation of the SIFSIX-3-Zn Metal-Organic Framework: An Automated Computational Study
  B. B. Skjelstad, Y. Hijikata, S. Maeda, Inorg. Chem., 2023, 62, 3, 1210–1217
  DOI: 10.1021/acs.inorgchem.2c03681
  
• Geometrical Analysis Identified Morphological Features of Hydrogel- Induced Cancer Stem Cells in Synovial Sarcoma Model Cells
  Z. Ferdous, J. E. Clement, J. P. Gong, S. Tanaka, T. Komatsuzaki, M. Tsuda, Biochemical and Biophysical Research Communications, 2023, 642, 41-49
  DOI: 10.1016/j.bbrc.2022.12.040
  

2022年

• Absorption Spectra of Calix 3 Pyrrole Analogs as Probes for Contracted Macrocycles
  K. Watanabe, R. Saha, Y. Inaba, Y. Manabe, T. Yoneda, Y. Ide, Y. Hijikata, Y. Inokuma, Journal of Porphyrins and Phthalocyanines, 2022, ,
  DOI: 10.1142/s1088424622500754
  
• Enhanced Circularly Polarized Luminescence of Chiral Eu(iii) Coordination Polymers with Structural Strain
  M. Tsurui, Y. Kitagawa, S. Shoji, K. Fushimi, Y. Hasegawa, Dalton Trans., 2022, ,
  DOI: 10.1039/d2dt03422k
  
• Discrete Chiral Organic Nanotubes by Stacking Pillar 5 Arenes Using Covalent Linkages
  T. H. Shi, S. Fa, Y. Nagata, K. Wada, S. Ohtani, K. Kato, T. Ogoshi, Cell Reports Physical Science, 2022, 3,
  DOI: 10.1016/j.xcrp.2022.101173
  
• A Twisted Chiral Cavitand with 5-Fold Symmetry and Its Length- Selective Binding Properties
  T. H. Shi, Y. Nagata, S. Akine, S. Ohtani, K. Kato, T. Ogoshi, J. Am. Chem. Soc., 2022, 144, 51, 23677–23684
  DOI: 10.1021/jacs.2c11225
  
• Effect of Salt on Dynamic Mechanical Behaviors of Polyampholyte Hydrogels
  X. Y. Li, F. Luo, T. L. Sun, K. P. Cui, R. Watanabe, T. Nakajima, J. P. Gong, Macromolecules, 2022, ,
  DOI: 10.1021/acs.macromol.2c02003
  
• ERK MAP Kinase Signaling Regulates RAR Signaling to Confer Retinoid Resistance on Breast Cancer Cells
  A. Hirota, J. E. Clement, S. Tanikawa, T. Nonoyama, T. Komatsuzaki, J. P. Gong, S. Tanaka, M. Imajo, Cancers, 2022, 14,
  DOI: 10.3390/cancers14235890
  
• Neutrophil Phenotypes Implicated in the Pathophysiology of Post-Traumatic Sepsis
  A. Mizugaki, T. Wada, T. Tsuchida, Y. Oda, K. Kayano, K. Yamakawa, S. Tanaka, Frontiers in Medicine, 2022, 9,
  DOI: 10.3389/fmed.2022.982399
  
• Boron Catalysis in the Transformation of Carboxylic Acids and Carboxylic Acid Derivatives
  M. Sawamura, Y. Shimizu, European Journal of Organic Chemistry, 2022, ,
  DOI: 10.1002/ejoc.202201249
  
• Mechanochemical Protocol Facilitates the Generation of Arylmanganese Nucleophiles from Unactivated Manganese Metal
  R. Takahashi, P. Gao, K. Kubota, H. Ito, Chem. Sci., 2022, ,
  DOI: 10.1039/d2sc05468j
  
• Prediction of High-Yielding Single-Step or Cascade Pericyclic Reactions for the Synthesis of Complex Synthetic Targets
  T. Mita, H. Takano, H. Hayashi, W. Kanna, Y. Harabuchi, K. N. Houk, S. Maeda, J. Am. Chem. Soc., 2022, 144, 50, 22985–23000
  DOI: 10.1021/jacs.2c09830
  
• Germline PRDM1 Variant Rs2185379 in Long-Term Recurrence-Free Survivors of Advanced Ovarian Cancer
  T. Mitamura, T. Zhai, K. C. Hatanaka, Y. Hatanaka, T. Amano, L. Wang, S. Tanaka, H. Watari, Pharmacogenomics & Personalized Medicine, 2022, 15, 977-984
  DOI: 10.2147/pgpm.s387120
  
• Nanoscale TEM Imaging of Hydrogel Network Architecture
  R. Kiyama, M. Yoshida, T. Nonoyama, T. Sedlacik, H. Jinnai, T. Kurokawa, T. Nakajima, J. P. Gong, Adv. Mater., 2022, ,
  DOI: 10.1002/adma.202208902
  
• Oxidation and Reduction Pathways in the Knowles Hydroamination via a Photoredox-Catalyzed Radical Reaction
  Y. Harabuchi, H. Hayashi, H. Takano, T. Mita, S. Maeda, Angew. Chem., Int. Ed., 2022, ,
  DOI: 10.1002/anie.202211936
  
• Deep Convolutional Neural Networks for Generating Atomistic Configurations of Multi-Component Macromolecules from Coarse-Grained Models
  E. Christofi, A. Chazirakis, C. Chrysostomou, M. A. Nicolaou, W. Li, M. Doxastakis, V. A. Harmandaris, J. Chem. Phys., 2022, 157, 184903
  DOI: 10.1063/5.0110322
  
• How Double Dynamics Affects the Large Deformation and Fracture Behaviors of Soft Materials
  K. P. Cui, J. P. Gong, Journal of Rheology, 2022, 66, 1093-1111
  DOI: 10.1122/8.0000438
  
• A Semi-Automated Material Exploration Scheme to Predict the Solubilities of Tetraphenylporphyrin Derivatives
  R. Shirasawa, I. Takemura, S. Hattori, Y. Nagata, Communications Chemistry, 2022, 5, Article number: 158 (2022)
  DOI: 10.1038/s42004-022-00770-9
  
• A Theory-Driven Synthesis of Symmetric and Unsymmetric 1,2-Bis(diphenylphosphino)ethane Analogues via Radical Difunctionalization of Ethylene
  H. Takano, H. Katsuyama, H. Hayashi, W. Kanna, Y. Harabuchi, S. Maeda, T. Mita, Nat. Commun., 2022, 13, Article number: 7034 (2022)
  DOI: 10.1038/s41467-022-34546-5
  
• Multi-State Energy Landscape for Photoreaction of Stilbene and Dimethyl-Stilbene
  T. Tsutsumi, Y. Ono, T. Taketsugu, J. Chem. Theory Comput., 2022, ,
  DOI: 10.1021/acs.jctc.2c00560
  
• Cooperation of Zr(iv)-N and Zr(iv)-O Coordinate Bonds of Zr(iv)-Amide Ensures the Transparent and Tough Polyacrylamide Hydrogels
  C. L. Dong, M. F. Lu, H. L. Fan, Z. X. Jin, J. Mater. Chem. B, 2022, 10, 9258-9265
  DOI: 10.1039/d2tb01496c
  
• Development of a Quasi-on-Time ICP-OES for Analyzing Electrode Reaction Products
  A. Fujimura, S. Shoji, Y. Kitagawa, Y. Hasegawa, T. Doi, K. Fushimi, Electrochimica Acta, 2022, 433,
  DOI: 10.1016/j.electacta.2022.141246
  
• Theoretical Study of Carbon Isotope Effects in the Nonclassical Carbonyl Cation CO/ M(CO)(n) (+) (M = Cu, Ag, Au; n=1-4)
  Y. Ono, T. Tsutsumi, Y. Harabuchi, T. Taketsugu, Y. Fujii, Chemical Physics Letters, 2022, 806,
  DOI: 10.1016/j.cplett.2022.140008
  
• Intraoperative Rapid Immunohistochemistry with Noncontact Antibody Mixing for Undiagnosed Pulmonary Tumors
  K. Imai, H. Nanjo, W. Shigeeda, T. Sugai, T. Ito, Y. Maniwa, S. Takashima, H. Saito, N. Yanagawa, Y. Tanaka, T. Doi, Y. Hiroshima, K. Nomura, M. Tanino, S. Tanaka, Y. Minamiya, R. I. S. Grp, Cancer Sci., 2022, ,
  DOI: 10.1111/cas.15616
  
• Emission Properties of Eu(III) Complexes Containing Arsine and Phosphine Ligands with Annulated Structures
  T. Fujii, Y. Kitagawa, Y. Hasegawa, H. Imoto, K. Naka, Inorg. Chem., 2022, 61, 44,, 17662–17672
  DOI: 10.1021/acs.inorgchem.2c02757
  
• Virological Characteristics of the SARS-CoV-2 Omicron BA.2 Subvariants, Including BA.4 and BA.5
  I. Kimura, D. Yamasoba, T. Tamura, N. Nao, T. Suzuki, Y. Oda, S. Mitoma, J. Ito, H. Nasser, J. Zahradnik, K. Uriu, S. Fujita, Y. Kosugi, L. Wang, M. Tsuda, M. Kishimoto, H. Ito, R. Suzuki, R. Shimizu, M. M. Begum, K. Yoshimatsu, K. T. Kimura, J. Sasaki, K. Sasaki-Tabata, Y. Yamamoto, T. Nagamoto, J. Kanamune, K. Kobiyama, H. Asakura, M. Nagashima, K. Sadamasu, K. Yoshimura, K. Shirakawa, A. Takaori-Kondo, J. Kuramochi, G. Schreiber, K. J. Ishii, T. Hashiguchi, T. Ikeda, A. Saito, T. Fukuhara, S. Tanaka, K. Matsuno, K. Sato, G. P. J. Genotype Phenotype Japan, Cell, 2022, 185, 3992-4007.e16
  DOI: 10.1016/j.cell.2022.09.018
  
• Plant Growth Acceleration Using a Transparent Eu3+-Painted UV-to-Red Conversion Film
  S. Shoji, H. Saito, Y. Jitsuyama, K. Tomita, Q. Haoyang, Y. Sakurai, Y. Okazaki, K. Aikawa, Y. Konishi, K. Sasaki, K. Fushimi, Y. Kitagawa, T. Suzuki, Y. Hasegawa, Scientific Reports, 2022, 12,
  DOI: 10.1038/s41598-022-21427-6
  
• Nickel-Catalyzed Defluorophosphonylation of Aryl Fluorides
  Z. S. You, Y. Masuda, T. Iwai, K. Higashida, M. Sawamura, J. Org. Chem., 2022, 87, 21, 14731–14737
  DOI: 10.1021/acs.joc.2c02048
  
• Rate-Independent Self-Healing Double Network Hydrogels Using a Thixotropic Sacrificial Network
  T. Yasui, Y. Zheng, T. Nakajima, E. Kamio, H. Matsuyama, J. P. Gong, Macromolecules, 2022, 55, 21, 9547–9557
  DOI: 10.1021/acs.macromol.2c01425
  
• Experimental and Theoretical Evidence for Relativistic Catalytic Activity in C-H Activation of N-Phenylbenzamide Using a Cationic Iridium Complex
  C. Takashima, H. Kurita, H. Takano, Y. Ikabata, T. Shibata, H. Nakai, J. Phys. Chem. A, 2022, 126, 42, 7627–7638
  DOI: 10.1021/acs.jpca.2c04747
  
• Force-Triggered Rapid Microstructure Growth on Hydrogel Surface for On-Demand Functions
  Q. F. Mu, K. P. Cui, Z. J. Wang, T. Matsuda, W. Cui, H. Kato, S. Namiki, T. Yamazaki, M. Frauenlob, T. Nonoyama, M. Tsuda, S. Tanaka, T. Nakajima, J. P. Gong, Nat. Commun., 2022, 13,
  DOI: 10.1038/s41467-022-34044-8
  
• An Autopsy Case Report of Adult-Onset Krabbe Disease: Comparison with an Infantile-Onset Case
  M. Sasaki, M. Ebata, Z. Tanei, Y. Oda, A. Hamauchi, S. Tanikawa, H. Sugino, Y. Ishida, T. Abe, N. Arai, K. Sako, S. Tanaka, Pathology International, 2022, ,
  DOI: 10.1111/pin.13275
  
• Oxyl Character and Methane Hydroxylation Mechanism in Heterometallic M(O)Co3O4 Cubanes (M = Cr, Mn, Fe, Mo, Tc, Ru, and Rh)
  B. B. Skjelstad, T. Helgaker, S. Maeda, D. Balcells, Acs Catalysis, 2022, 12, 19, 12326-12335
  DOI: 10.1021/acscatal.2c03748
  
• Reactive Orbital Energy Theory Serving a Theoretical Foundation for the Electronic Theory of Organic Chemistry
  T. Tsuneda, H. Sumitomo, M. Hasebe, T. Tsutsumi, T. Taketsugu, Journal of Computational Chemistry, 2022, ,
  DOI: 10.1002/jcc.27017
  
• Mechanism of Temperature-Induced Asymmetric Swelling and Shrinking Kinetics in Self-Healing Hydrogels
  K. P. Cui, C. T. Yu, Y. N. Ye, X. Y. Li, J. P. Gong, Proceedings of the National Academy of Sciences of the United States of America, 2022, 119,
  DOI: 10.1073/pnas.220742211
  
• Virological Characteristics of the SARS-CoV-2 Omicron BA.2.75 Variant
  A. Saito, T. Tamura, J. Zahradnik, S. Deguchi, K. Tabata, Y. Anraku, I. Kimura, J. Ito, D. Yamasoba, H. Nasser, M. Toyoda, K. Nagata, K. Uriu, Y. Kosugi, S. Fujita, M. Shofa, M. M. Begum, R. Shimizu, Y. Oda, R. Suzuki, H. Ito, N. Nao, L. Wang, M. Tsuda, K. Yoshimatsu, J. Kuramochi, S. Kita, K. Sasaki-Tabata, H. Fukuhara, K. Maenaka, Y. Yamamoto, T. Nagamoto, H. Asakura, M. Nagashima, K. Sadamasu, K. Yoshimura, T. Ueno, G. Schreiber, A. Takaori-Kondo, K. Shirakawa, H. Sawa, T. Irie, T. Hashiguchi, K. Takayama, K. Matsuno, S. Tanaka, T. Ikeda, T. Fukuhara, K. Sato, G. P. J. Genotype Phenotype Japan, Cell Host & Microbe, 2022, 30, 1540-+
  DOI: 10.1016/j.chom.2022.10.003
  
• Amorphous Lanthanide Complexes for Organic Luminescent Materials
  J. Hayashi, S. Shoji, Y. Kitagawa, Y. Hasegawa, Coord. Chem. Rev., 2022, 467,
  DOI: 10.1016/j.ccr.2022.214607
  
• Iron/Photosensitizer Hybrid System Enables the Synthesis of Polyaryl-Substituted Azafluoranthenes
  Y. Kato, T. Yoshino, M. Gao, J. Y. Hasegawa, M. Kojima, S. Matsunaga, J. Am. Chem. Soc., 2022, ,
  DOI: 10.1021/jacs.2c06993
  
• Catalytic Umpolung Carboxylation of Pi-AllylPalladium Species with Carbon Dioxide
  T. Mita, Y. Higuchi, Y. Sato, J. Syn. Org. Chem. Jpn., 2022, 80, 806-816
  DOI: 10.5059/yukigoseikyokaishi.80.806
  
• Delayed Fluorescence from Inverted Singlet and Triplet Excited States
  N. Aizawa, Y. J. Pu, Y. Harabuchi, A. Nihonyanagi, R. Ibuka, H. Inuzuka, B. Dhara, Y. Koyama, K. I. Nakayama, S. Maeda, F. Araoka, D. Miyajima, Nature, 2022, 609, 502–506
  DOI: 10.1038/s41586-022-05132-y
  
• Analysis of Clinicopathological Features and NAB2-STAT6 Fusion Variants of Meningeal Solitary Fibrous Tumor with Ectopic Salivary Gland Components in the Cerebellopontine Angle
  T. Shirakura, Y. Yamada, S. Nakata, B. Asayama, Y. Seo, S. Tanikawa, T. Kato, N. Komoribayashi, N. Kubo, N. Monma, N. Okura, S. Tanaka, Y. Oda, J. Hirato, H. Yokoo, S. Nobusawa, Virchows Archiv, 2022, ,
  DOI: 10.1007/s00428-022-03403-7
  
• Evaluation of the Context of Downstream N- and Free N-Glycomic Alterations Induced by Swainsonine in HepG2 Cells
  C. Morikawa, K. Sugiura, K. Kondo, Y. Yamamoto, Y. Kojima, Y. Ozawa, H. Yoshioka, N. Miura, J. H. Piao, K. Okada, H. Hanamatsu, M. Tsuda, S. Tanaka, J. I. Furukawa, Y. Shinohara, Biochimica Et Biophysica Acta-General Subjects, 2022, 1866,
  DOI: 10.1016/j.bbagen.2022.130168
  
• Extension of Natural Reaction Orbital Approach to Multiconfigurational Wavefunctions
  S. Ebisawa, T. Tsutsumi, T. Taketsugu, J. Chem. Phys., 2022, 157,
  DOI: 10.1063/5.0098230
  
• Triblock Copolymer Micelle Model of Spherical Paraspeckles
  T. Yamamoto, T. Yamazaki, T. Hirose, Frontiers in Molecular Biosciences, 2022, 9,
  DOI: 10.3389/fmolb.2022.925058
  
• Micellization: A New Principle in the Formation of Biomolecular Condensates
  T. Yamazaki, T. Yamamoto, T. Hirose, Frontiers in Molecular Biosciences, 2022, 9,
  DOI: 10.3389/fmolb.2022.974772
  
• Ligand Release from Silicon Phthalocyanine Dyes Triggered by X-Ray Irradiation
  H. Takakura, S. Matsuhiro, O. Inanami, M. Kobayashi, K. Saita, M. Yamashita, K. Nakajima, M. Suzuki, N. Miyamoto, T. Taketsugu, M. Ogawa, Org. Biomol. Chem., 2022, 20, 7270-7277
  DOI: 10.1039/d2ob00957a
  
• Cu(I)-Catalyzed Enantioselective Gamma-Boryl Substitution of Trifluoromethyl- and Silyl-Substituted Alkenes
  N. Oyama, S. Akiyama, K. Kubota, T. Imamoto, H. Ito, European Journal of Organic Chemistry, 2022, 2022,
  DOI: 10.1002/ejoc.202200664
  
• Designing Adsorptive Gating via Linker Side-Chain Functionalization in a Honeycomb-MOF
  J. Berger, A. Schneemann, I. Hante, Y. Jing, J. D. Evans, Y. Hijikata, J. Pirillo, T. Toyao, K. I. Shimizu, S. I. Noro, G. Kieslich, R. A. Fischer, J. Phys. Chem. C, 2022, 126, 12755-12764
  DOI: 10.1021/acs.jpcc.2c01979
  
• Calcium Sparks Enhance the Tissue Fluidity Within Epithelial Layers and Promote Apical Extrusion of Transformed Cells
  K. Kuromiya, K. Aoki, K. Ishibashi, M. Yotabun, M. Sekai, N. Tanimura, S. Iijima, S. Ishikawa, T. Kamasaki, Y. Akieda, T. Ishitani, T. Hayashi, S. Toda, K. Yokoyama, C. G. Lee, I. Usami, H. Inoue, I. Takigawa, E. Gauquelin, K. Sugimura, N. Hino, Y. Fujita, Cell Reports, 2022, 2022 Jul 12;40(2), 11107840
  DOI: 10.1016/j.celrep.2022.111078
  
• Solid-State Cross-Coupling Reactions of Insoluble Aryl Halides under Polymer-Assisted Grinding Conditions
  K. Kubota, T. Seo, H. Ito, Faraday Discussions, 2022, ,
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• Molecular Electrides: An In Silico Perspective
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  A. Jancarik, J. Holec, Y. Nagata, M. Samal, A. Gourdon, Nat. Commun., 2022, 13,
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• Early Detection of Nucleation Events From Solution in LC-TEM by Machine Learning
  H. Katsuno, Y. Kimura, T. Yamazaki, I. Takigawa, Frontiers in Chemistry, 2022, 10,
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• Selecting Molecules with Diverse Structures and Properties by Maximizing Submodular Functions of Descriptors Learned with Graph Neural Networks
  T. Nakamura, S. Sakaue, K. Fujii, Y. Harabuchi, S. Maeda, S. Iwata, Scientific Reports, 2022, 12,
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• Richard Stephen Berry (1931-2020)
  S. Keshavamurthy, T. Komatsuzaki, D. Leitner, Resonance-Journal of Science Education, 2022, 27, 11-17
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• Facile Preparation of Cellulose Hydrogel with Achilles Tendon-like Super Strength through Aligning Hierarchical Fibrous Structure
  Y. Z. Guo, T. Nakajima, M. T. I. Mredha, H. L. Guo, K. P. Cui, Y. Zheng, W. Cui, T. Kurokawa, J. P. Gong, Chemical Engineering Journal, 2022, 428,
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• Synthesis, Structure, and Dynamics of Chiral Eight-Membered Cyclic Molecules with Thienylene and Cyclopropylene Units Alternately Connected
  T. Miura, Y. Ishihara, T. Nakamuro, S. Moritani, Y. Nagata, M. Murakami, Chem. Eur. J., 2022, 28,
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• Young Career Focus: Professor Yuuya Nagata (Hokkaido University, Sapporo, Japan)
  Y. Nagata, Synlett, 2022, 33, A3-A4
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• Late-Stage Modification of Pi-Electron Systems Based on Asymmetric Oxidation of a Medium-Sized Sulfur-Containing Ring
  M. Hayakawa, S. Horike, Y. Hijikata, K. Yasui, S. Yamaguchi, A. Fukazawa, Chem. Commun., 2022, 58, 2548-2551
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• Cubically Cage-Shaped Mesoporous Ordered Silica for Simultaneous Visual Detection and Removal of Uranium Ions from Contaminated Seawater
  D. A. Tolan, E. A. Elshehy, W. A. El-Said, T. Taketsugu, K. Yoshizawa, A. M. El-Nahas, A. R. Kamali, A. M. Abdelkader, Microchimica Acta, 2022, 189,
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• Exploration of the Chemical Space of DNA-Encoded Libraries
  R. Pikalyova, Y. Zabolotna, D. M. Volochnyuk, D. Horvath, G. Marcou, A. Varnek, Molecular Informatics, 2022, 41,
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• An H₂O₂ Molecule Stabilized inside Open-Cage C₆₀ Derivatives by a Hydroxy Stopper
  G. Huang, S. Hasegawa, Y. Hashikawa, Y. Ide, T. Hirose, Y. Murata, Chem. Eur. J., 2022, 28, e202103836
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2021年

• Phase Space Geometry of Isolated to Condensed Chemical Reactions
  Y. Nagahata, R. Hernandez, T. Komatsuzaki, J. Chem. Phys., 2021, 155,
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• In Situ Evaluation of the Polymer Concentration Distribution of Microphase-Separated Polyelectrolyte Hydrogels by the Microelectrode Technique
  T. Nishimura, H. L. Guo, R. Kiyama, Y. Katsuyama, J. P. Gong, T. Kurokawa, Macromolecules, 2021, 54, 10776-10785
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• Hydration, Prediction of the pK(a), and Infrared Spectroscopic Study of Sulfonated Polybenzophenone (SPK) Block-Copolymer Hydrocarbon Membranes and Comparisons with Nafion
  S. Singh, T. Taketsugu, R. K. Singh, Acs Omega, 2021, 6, 32739-32748
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• Palladium-Catalyzed Solid-State Polyfluoroarylation of Aryl Halides Using Mechanochemistry
  R. Takahashi, T. Seo, K. Kubota, H. Ito, Acs Catalysis, 2021, 11, 14803-14810
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• Radical Difunctionalization of Gaseous Ethylene Guided by Quantum Chemical Calculations: Selective Incorporation of Two Molecules of Ethylene
  H. Takano, Y. You, H. Hayashi, Y. Harabuchi, S. Maeda, T. Mita, Acs Omega, 2021, 6, 33846-33854
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• Catalytic Asymmetric Additions of Enol Silanes to In Situ Generated Cyclic, Aliphatic N-Acyliminium Ions
  O. Grossmann, R. Maji, M. H. Aukland, S. Lee, B. List, Angew. Chem., Int. Ed., 2021, 61,
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• A Close-up Look at the Chemical Space of Commercially Available Building Blocks for Medicinal Chemistry
  Y. Zabolotna, D. M. Volochnyuk, S. V. Ryabukhin, D. Horvath, K. S. Gavrilenko, G. Marcou, Y. S. Moroz, O. Oksiuta, A. Varnek, J. Chem. Inf. Model., 2021, 62, 2171-2185
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• Visible Light-Induced Reductive Alkynylation of Aldehydes by Umpolung Approach
  I. Tanaka, M. Sawamura, Y. Shimizu, Org. Lett., 2021, 24, 520-524
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• In-Situ Observation of Corrosion Initiation Occurring on NaCI Nanoparticles-Deposited Carbon Steel Surfaces
  K. Fushimi, H. Okuyama, K. Ohshimizu, S. Shoji, Y. Kitagawa, Y. Hasegawa, Tetsu to Hagane-Journal of the Iron and Steel Institute of Japan, 2021, 107, 1011-1019
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• Bright Red Emission with High Color Purity from Eu(iii) Complexes with Pi-Conjugated Polycyclic Aromatic Ligands and Their Sensing Applications
  Y. Kitagawa, M. Tsurui, Y. Hasegawa, RSC Advances, 2021, 12, 810-821
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• Efficient Access to Materials-Oriented Aromatic Alkynes via the Mechanochemical Sonogashira Coupling of Solid Aryl Halides with Large Polycyclic Conjugated Systems
  Y. P. Gao, C. Feng, T. Seo, K. Kubota, H. Ito, Chem. Sci., 2021, 13, 430-438
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• Designing Two-Dimensional Dodecagonal Boron Nitride
  H. Suzuki, I. Miyazato, T. Hussain, F. Ersan, S. Maeda, K. Takahashi, Crystengcomm, 2021, 24, 471-474
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• Distinct Fold-Mode Formation of Crystalline Cu(I) Helical Coordination Polymers with Alternation of the Solid-State Emission Using Shape of the Counter Anions
  M. Jin, R. Ando, H. Ito, Inorg. Chem., 2021, 61, 3-9
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• How Chain Dynamics Affects Crack Initiation in Double-Network Gels
  Y. Zheng, T. Matsuda, T. Nakajima, W. Cui, Y. Zhang, C. Y. Hui, T. Kurokawa, J. P. Gong, Proceedings of the National Academy of Sciences of the United States of America, 2021, 118,
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• An Algorithm for Computing Phase Space Structures in Chemical Reaction Dynamics Using Voronoi Tessellation
  Y. Mizuno, M. Takigawa, S. Miyashita, Y. Nagahata, H. Teramoto, T. Komatsuzaki, Physica D-Nonlinear Phenomena, 2021, 428,
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• Revisiting the Origins of the Fracture Energy of Tough Double-Network Hydrogels with Quantitative Mechanochemical Characterization of the Damage Zone
  T. Matsuda, R. Kawakami, T. Nakajima, Y. Hane, J. P. Gong, Macromolecules, 2021, 54, 10331-10339
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• Machine Learning Modelling of Chemical Reaction Characteristics: Yesterday, Today, Tomorrow
  T. I. Madzhidov, A. Rakhimbekova, V. A. Afonina, T. R. Gimadiev, R. N. Mukhametgaleev, R. I. Nugmanov, I. Baskinc, A. Varnekkd, Mendeleev Communications, 2021, 31, 769-780
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• Enhanced Fusogenicity and Pathogenicity of SARS-CoV-2 Delta P681R Mutation
  A. Saito, T. Irie, R. Suzuki, T. Maemura, H. Nasser, K. Uriu, Y. Kosugi, K. Shirakawa, K. Sadamasu, I. Kimura, J. Ito, J. Q. Wu, K. Iwatsuki-Horimoto, M. Ito, S. Yamayoshi, S. Loeber, M. Tsuda, L. Wang, S. Ozono, E. P. Butlertanaka, Y. L. Tanaka, R. Shimizu, K. Shimizu, K. Yoshimatsu, R. Kawabata, T. Sakaguchi, K. Tokunaga, I. Yoshida, H. Asakura, M. Nagashima, Y. Kazuma, R. Nomura, Y. Horisawa, K. Yoshimura, A. Takaori-Kondo, M. Imai, S. Tanaka, S. Nakagawa, T. Ikeda, T. Fukuhara, Y. Kawaoka, K. Sato, G. P. J. Genotype Phenotype Japan, Nature, 2021, 602, 300-+
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• Cyclodextrins with Multiple Pyrenyl Groups: An Approach to Organic Molecules Exhibiting Bright Excimer Circularly Polarized Luminescence
  H. Shigemitsu, K. Kawakami, Y. Nagata, R. Kajiwara, S. Yamada, T. Mori, T. Kida, Angew. Chem., Int. Ed., 2021, 61,
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• Solid-State C-N Cross-Coupling Reactions with Carbazoles as Nitrogen Nucleophiles Using Mechanochemistry
  K. Kubota, T. Endo, M. Uesugi, Y. Hayashi, H. Ito, ChemSusChem, 2021, 15,
  DOI: 10.1002/cssc.202102132
  
• One-to-One Correspondence between Reaction Pathways and Reactive Orbitals
  M. Hasebe, T. Tsutsumi, T. Taketsugu, T. Tsuneda, J. Chem. Theory Comput., 2021, 17, 6901-6909
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• Alkali Metal Fluorides in Fluorinated Alcohols: Fundamental Properties and Applications to Electrochemical Fluorination
  N. Shida, H. Takenaka, A. Gotou, T. Isogai, A. Yamauchi, Y. Kishikawa, Y. Nagata, I. Tomita, T. Fuchigami, S. Inagi, J. Org. Chem., 2021, 86, 16128-16133
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• Mechanochemical Synthesis of Magnesium-Based Carbon Nucleophiles in Air and Their Use in Organic Synthesis
  R. Takahashi, A. Q. Hu, P. Gao, Y. P. Gao, Y. D. Pang, T. Seo, J. L. Jiang, S. Maeda, H. Takaya, K. Kubota, H. Ito, Nat. Commun., 2021, 12,
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• Natural Reaction Orbitals for Characterizing Electron Transfer Responsive to Nuclear Coordinate Displacement
  S. Ebisawa, M. Hasebe, T. Tsutsumi, T. Tsuneda, T. Taketsugu, Phys. Chem. Chem. Phys., 2021, 24, 3532-3545
  DOI: 10.1039/d1cp04491e
  
• Tyrosine-Based Photoluminescent Diketopiperazine Supramolecular Aggregates
  N. Shimosaraya, T. Sotani, Y. Miyagi, E. A. Q. Mondarte, K. Suthiwanich, T. Hayashi, Y. Nagata, H. Sogawa, F. Sanda, Soft Matter, 2021, 18, 137-145
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• Flexibility Control of Two-Dimensional Coordination Polymers by Crystal Morphology: Water Adsorption and Thermal Expansion
  R. Ohtani, H. Yoshino, J. Yanagisawa, H. Ohtsu, D. Hashizume, Y. Hijikata, J. Pirillo, M. Sadakiyo, K. Kato, Y. Shudo, S. Hayami, B. Le Ouay, M. Ohba, Chem. Eur. J., 2021, 27, 18135-18140
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• Overlap Concentration in Salt-Free Polyelectrolyte Solutions
  J. A. Bollinger, G. S. Grest, M. J. Stevens, M. Rubinstein, Macromolecules, 2021, 54, 10068-10073
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• Tiny yet Tough: Maximizing the Toughness of Fiber-Reinforced Soft Composites in the Absence of a Fiber-Fracture Mechanism
  W. Cui, Y. W. Huang, L. Chen, Y. Zheng, Y. Saruwatari, C. Y. Hui, T. Kurokawa, D. R. King, J. P. Gong, Matter, 2021, 4, 3646-3661
  DOI: 10.1016/j.matt.2021.08.013
  
• A Simplified Methodology for the Modeling of Interfaces of Elementary Metals
  Y. Hinuma, I. Takigawa, M. Kohyama, S. Tanaka, Aip Advances, 2021, 11,
  DOI: 10.1063/5.0063715
  
• Barium Oxide Encapsulating Cobalt Nanoparticles Supported on Magnesium Oxide: Active Non-Noble Metal Catalysts for Ammonia Synthesis under Mild Reaction Conditions
  K. Sato, S. Miyahara, K. Tsujimaru, Y. Wada, T. Toriyama, T. Yamamoto, S. Matsumura, K. Inazu, H. Mohri, T. Iwasa, T. Taketsugu, K. Nagaoka, Acs Catalysis, 2021, 11, 13050-13061
  DOI: 10.1021/acscatal.1c02887
  
• Loss of FAM83H Promotes Cell Migration and Invasion in Cutaneous Squamous Cell Carcinoma via Impaired Keratin Distribution
  K. Tokuchi, S. Kitamura, T. Maeda, M. Watanabe, S. Hatakeyama, S. Kano, S. Tanaka, H. Ujiie, T. Yanagi, Journal of Dermatological Science, 2021, 104, 112-121
  DOI: 10.1016/j.jdermsci.2021.09.007
  
• Reply to the 'Comment on "Theoretical Investigations on Hydrogen Peroxide Decomposition in Aquo"' by W. H. Koppenol, Phys. Chem. Chem. Phys., 2021, 23, DOI: 10.1039/D1CP03545B
  T. Tsuneda, T. Taketsugu, Phys. Chem. Chem. Phys., 2021, 23, 26006-26008
  DOI: 10.1039/d1cp04003k
  
• Structure Frustration Enables Thermal History-Dependent Responsive Behavior in Self-Healing Hydrogels
  C. T. Yu, K. P. Cui, H. L. Guo, Y. N. Ye, X. Y. Li, J. P. Gong, Macromolecules, 2021, 54, 9927-9936
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• Atom-to-Atom Mapping: A Benchmarking Study of Popular Mapping Algorithms and Consensus Strategies
  A. Lin, N. Dyubankova, T. I. Madzhidov, R. I. Nugmanov, J. Verhoeven, T. R. Gimadiev, V. A. Afonina, Z. Ibragimova, A. Rakhimbekova, P. Sidorov, A. Gedich, R. Suleymanov, R. Mukhametgaleev, J. Wegner, H. Ceulemans, A. Varnek, Molecular Informatics, 2021, 41,
  DOI: 10.1002/minf.202100138
  
• Structural Characterization of Nickel-Doped Aluminum Oxide Cations by Cryogenic Ion Trap Vibrational Spectroscopy
  Y. K. Li, M. C. Babin, S. Debnath, T. Iwasa, S. Kumar, T. Taketsugu, K. R. Asmis, A. Lyalin, D. M. Neumark, J. Phys. Chem. A, 2021, 125, 9527-9535
  DOI: 10.1021/acs.jpca.1c07156
  
• Hydroxyapatite-Hybridized Double-Network Hydrogel Surface Enhances Differentiation of Bone Marrow-Derived Mesenchymal Stem Cells to Osteogenic Cells
  T. Kaibara, L. Wang, M. Tsuda, T. Nonoyama, T. Kurokawa, N. Iwasaki, J. P. Gong, S. Tanaka, K. Yasuda, Journal of Biomedical Materials Research Part A, 2021, 110, 747-760
  DOI: 10.1002/jbm.a.37324
  
• Charge-Transfer Excited States of Pi- and 4f-Orbitals for Development of Luminescent Eu(iii) Complexes
  Y. Kitagawa, P. P. F. da Rosa, Y. Hasegawa, Dalton Trans., 2021, 50, 14978-14984
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• A Dataset of Computational Reaction Barriers for the Claisen Rearrangement: Chemical and Numerical Analysis
  H. Okada, S. Maeda, Molecular Informatics, 2021, 41,
  DOI: 10.1002/minf.202100216
  
• Carboxylation of a Palladacycle Formed via C(sp(3))-H Activation: Theory-Driven Reaction Design
  W. Kanna, Y. Harabuchi, H. Takano, H. Hayashi, S. Maeda, T. Mita, Chem. Asian J., 2021, 16, 4072-4080
  DOI: 10.1002/asia.202100989
  
• Aberrant Expression of MYD88 via RNA-Controlling CNOT4 and EXOSC3 in Colonic Mucosa Impacts Generation of Colonic Cancer
  M. Tsuda, M. Noguchi, T. Kurai, Y. Ichihashi, K. Ise, L. Wang, Y. Ishida, M. Tanino, S. Hirano, M. Asaka, S. Tanaka, Cancer Sci., 2021, 112, 5100-5113
  DOI: 10.1111/cas.15157
  
• Pt(ii)-Chiral Diene-Catalyzed Enantioselective Formal 4+2 Cycloaddition Initiated by C-C Bond Cleavage and Elucidation of a Pt(ii)/(iv) Cycle by DFT Calculations
  T. Shibata, N. Shiozawa, S. Nishibe, H. Takano, S. Maeda, Organic Chemistry Frontiers, 2021, 8, 6985-6991
  DOI: 10.1039/d1qo01467f
  
• Visualization of Reaction Route Map and Dynamical Trajectory in Reduced Dimension
  T. Tsutsumi, Y. Ono, T. Taketsugu, Chem. Commun., 2021, 57, 11734-11750
  DOI: 10.1039/d1cc04667e
  
• Synthesis of C,N,N-Cyclometalated Gold(III) Complexes with Anionic Amide Ligands
  R. Niizeki, K. Higashida, E. Mejri, M. Sawamura, Y. Shimizu, Synlett, 2021, 33, 288-292
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• Universal Polymeric-to-Colloidal Transition in Melts of Hairy Nanoparticles
  D. Parisi, E. Buenning, N. Kalafatakis, L. Gury, B. C. Benicewicz, M. Gauthier, M. Cloitre, M. Rubinstein, S. K. Kumar, D. Vlassopoulos, Acs Nano, 2021, 15, 16697-16708
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• Toughening Hydrogels through Force-Triggered Chemical Reactions that Lengthen Polymer Strands
  Z. Wang, X. J. Zheng, T. Ouchi, T. B. Kouznetsova, H. K. Beech, S. Av-Ron, T. Matsuda, B. H. Bowser, S. Wang, J. A. Johnson, J. A. Kalow, B. D. Olsen, J. P. Gong, M. Rubinstein, S. L. Craig, Science, 2021, 374, 193-+
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• Tough Hydrogels with Dynamic H-Bonds: Structural Heterogeneities and Mechanical Performances
  W. Z. Lian, Z. W. Fan, K. P. Cui, P. C. Yin, J. S. Yang, H. Jiang, L. Q. Tang, T. L. Sun, Macromolecules, 2021, 54, 8996-9006
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• An Elastic Metal-Organic Crystal with a Densely Catenated Backbone
  W. J. Meng, S. Kondo, T. Ito, K. Komatsu, J. Pirillo, Y. Hijikata, Y. Ikuhara, T. Aida, H. Sato, Nature, 2021, 598, 298-+
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• A Comparative Study of Structural, Electronic, and Optical Properties of Thiolated Gold Clusters with Icosahedral vs Face-Centered Cubic Cores
  M. Miyamoto, T. Taketsugu, T. Iwasa, J. Chem. Phys., 2021, 155,
  DOI: 10.1063/5.0057566
  
• Versatile Transformations of Biphenylenes by Transition-Metal Catalysts and Application for the Synthesis of Polycyclic Hydrocarbons
  H. Takano, T. Shibata, J. Syn. Org. Chem. Jpn., 2021, 79, 849-858
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• Bioinspired Underwater Adhesives
  H. L. Fan, J. P. Gong, Adv. Mater., 2021, 33,
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• Structure and Unique Functions of Anisotropic Hydrogels Comprising Uniaxially Aligned Lamellar Bilayers
  Y. F. Yue, J. P. Gong, Bulletin of the Chemical Society of Japan, 2021, 94, 2221-2234
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• Regio- and Stereoselective Synthesis of Multi-Alkylated Allylic Boronates through Three-Component Coupling Reactions between Allenes, Alkyl Halides, and a Diboron Reagent
  Y. Ozawa, K. Endo, H. Ito, J. Am. Chem. Soc., 2021, 143, 13865-13877
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• Accumulated Lattice Strain as an Internal Trigger for Spontaneous Pathway Selection
  H. B. Huang, H. Sato, J. Pirillo, Y. Hijikata, Y. S. Zhao, S. Z. D. Cheng, T. Aida, J. Am. Chem. Soc., 2021, 143, 15319-15325
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• Polyketone-Based Molecular Ropes as Versatile Components for Functional Materials
  Y. Inokuma, Y. Inaba, Bulletin of the Chemical Society of Japan, 2021, 94, 2187-2194
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• Honeycomb Boron on Al(111): From the Concept of Borophene to the Two-Dimensional Boride
  A. B. Preobrajenski, A. Lyalin, T. Taketsugu, N. A. Vinogradov, A. S. Vinogradov, Acs Nano, 2021, 15, 15153-15165
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• Switching the Relaxation Pathway by Steric Effects in Conjugated Dienes
  T. Tentaku, R. Atobe, T. Tsutsumi, S. Satoh, Y. Harabuchi, T. Taketsugu, T. Sekikawa, Journal of Physics B-Atomic Molecular and Optical Physics, 2021, 54,
  DOI: 10.1088/1361-6455/ac274c
  
• Confinement-Controlled, Either Syn- or Anti-Selective Catalytic Asymmetric Mukaiyama Aldolizations of Propionaldehyde Enolsilanes
  T. Amatov, N. Tsuji, R. Maji, L. Schreyer, H. Zhou, M. Leutzsch, B. List, J. Am. Chem. Soc., 2021, 143, 14475-14481
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• Catalytic Functionalization of Hexagonal Boron Nitride for Oxidation and Epoxidation Reactions by Molecular Oxygen
  M. Gao, B. Wang, T. Tsuneda, A. Lyalin, T. Taketsugu, J. Phys. Chem. C, 2021, 125, 19219-19228
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• Biomaterials for Intestinal Organoid Technology and Personalized Disease Modeling
  A. Hirota, S. AlMusawi, A. S. Nateri, P. Ordonez-Moran, M. Imajo, Acta Biomaterialia, 2021, 132, 272-287
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• Fast in Vivo Fixation of Double Network Hydrogel to Bone by Monetite Surface Hybridization
  T. Nonoyama, L. Wang, R. Kiyama, N. Kashimura, K. Yasuda, S. Tanaka, T. Kurokawa, J. P. Gong, Journal of the Ceramic Society of Japan, 2021, 129, 584-589
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• Charge-Transfer Crystal with Segregated Packing Structure Constructed with Hexaarylbenzene and Tetracyanoquinodimethane
  R. Ando, M. Jin, H. Ito, Crystengcomm, 2021, 23, 5564-5568
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• A Reaction Route Network for Methanol Decomposition on a Pt(111) Surface
  K. Sugiyama, K. Saita, S. Maeda, Journal of Computational Chemistry, 2021, 42, 2163-2169
  DOI: 10.1002/jcc.26746
  
• Automatic Determination of Buffer Region in Divide-Anc-Conquer Quantum Chemical Calculations
  M. Kobayashi, T. Fujimori, T. Taketsugu, Journal of Computer Chemistry-Japan, 2021, 20, 48-59
  DOI: 10.2477/jccj.2021-0025
  
• Reaction Data Curation I: Chemical Structures and Transformations Standardization
  T. R. Gimadiev, A. Lin, V. A. Afonina, D. Batyrshin, R. I. Nugmanov, T. Akhmetshin, P. Sidorov, N. Duybankova, J. Verhoeven, J. Wegner, H. Ceulemans, A. Gedich, T. I. Madzhidov, A. Varnek, Molecular Informatics, 2021, 40,
  DOI: 10.1002/minf.202100119
  
• Hybrid Eu-III Coordination Luminophore Standing on Two Legs on Silica Nanoparticles for Enhanced Luminescence
  T. Zhang, Y. Kitagawa, R. Moriake, P. P. F. da Rosa, M. J. Islam, T. Yoneda, Y. Inokuma, K. Fushimi, Y. Hasegawa, Chem. Eur. J., 2021, 27, 14438-14443
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• Isopyrazole-Masked Tetraketone: Tautomerism and Functionalization for Fluorescent Metal Ligands
  H. Shirakura, Y. Manabe, C. Kasai, Y. Inaba, M. Tsurui, Y. Kitagawa, Y. Hasegawa, T. Yoneda, Y. Ide, Y. Inokuma, European Journal of Organic Chemistry, 2021, 2021, 4345-4349
  DOI: 10.1002/ejoc.202100784
  
• Synthesis of Hydrosilylboronates via the Monoborylation of a Dihydrosilane Si-H Bond and Their Application for the Generation of Dialkylhydrosilyl Anions
  T. Takeuchi, R. Shishido, K. Kubota, H. Ito, Chem. Sci., 2021, 12, 11799-11804
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• Facile Tuning of Hydrogel Properties by Manipulating Cationic-Aromatic Monomer Sequences
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• Pre-Regulation of the Planar Chirality of Pillar 5 Arenes for Preparing Discrete Chiral Nanotubes
  S. X. Fa, K. Adachi, Y. Nagata, K. Egami, K. Kato, T. Ogoshi, Chem. Sci., 2021, 12, 3483-3488
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• Thermo-Sensitive Eu-III Coordination Polymers with Amorphous Networks
  Y. Hasegawa, N. Sato, J. Hayashi, Y. Kitagawa, K. Fushimi, ChemistrySelect, 2021, 6, 2812-2816
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• A Large Starphene Comprising Pentacene Branches
  J. Holec, B. Cogliati, J. Lawrence, A. Berdonces-Layunta, P. Herrero, Y. Nagata, M. Banasiewicz, B. Kozankiewicz, M. Corso, D. G. Oteyza, A. Jancarik, A. Gourdon, Angew. Chem., Int. Ed., 2021, 60, 7752-7758
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• Cross-Validation Strategies in QSPR Modelling of Chemical Reactions
  A. Rakhimbekova, T. N. Akhmetshin, G. I. Minibaeva, R. I. Nugmanov, T. R. Gimadiev, T. I. Madzhidov, I. Baskin, A. Varnek, Sar and Qsar in Environmental Research, 2021, 32, 207-219
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• Use of Imidazo 1,5-a Pyridin-3-Ylidene as a Platform for Metal-Imidazole Cooperative Catalysis: Silver-Catalyzed Cyclization of Alkyne-Tethered Carboxylic Acids
  V. K. Rawat, K. Higashida, M. Sawamura, Adv. Synth. Catal., 2021, 363, 1631-1637
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• Rapid Reprogramming of Tumour Cells into Cancer Stem Cells on Double-Network Hydrogels
  J. Suzuka, M. Tsuda, L. Wang, S. Kohsaka, K. Kishida, S. Semba, H. Sugino, S. Aburatani, M. Frauenlob, T. Kurokawa, S. Kojima, T. Ueno, Y. Ohmiya, H. Mano, K. Yasuda, J. P. Gong, S. Tanaka, Nature Biomedical Engineering, 2021, , 15
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• Phosphinylation of Non-Activated Aryl Fluorides through Nucleophilic Aromatic Substitution at the Boundary of Concerted and Stepwise Mechanisms
  Z. S. You, K. Higashida, T. Iwai, M. Sawamura, Angew. Chem., Int. Ed., 2021, 60, 5778-5782
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• Insoluble Pi-Conjugated Polyimine as an Organic Adsorbent for Group 10 Metal Ions
  H. Shirakura, Y. Hijikata, J. Pirillo, T. Yoneda, Y. Manabe, M. Murugavel, Y. Ide, Y. Inokuma, European Journal of Inorganic Chemistry, 2021, , 1705-1708
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• The Fracture of Highly Deformable Soft Materials: A Tale of Two Length Scales
  R. Long, C. Y. Hui, J. P. Gong, E. Bouchbinder, Annual Review of Condensed Matter Physics, Vol 12, 2021, 2021, 12, 71-94
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• Discovery of Novel Chemical Reactions by Deep Generative Recurrent Neural Network
  W. Bort, I. Baskin, T. Gimadiev, A. Mukanov, R. Nugmanov, P. Sidorov, G. Marcou, D. Horvath, O. Klimchuk, T. Madzhidov, A. Varnek, Scientific Reports, 2021, 11, 15
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• Combined Graph/Relational Database Management System for Calculated Chemical Reaction Pathway Data
  T. Gimadiev, R. Nugmanov, D. Batyrshin, T. Madzhidov, S. Maeda, P. Sidorov, A. Varnek, J. Chem. Inf. Model., 2021, 61, 554-559
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• Synthesis of 4-Hydroxy-2-Pyridinone Derivatives and Evaluation of Their Antioxidant/Anticancer Activities
  W. S. Hamama, E. A. Ghaith, M. E. Ibrahim, M. Sawamura, H. H. Zoorob, ChemistrySelect, 2021, 6, 1430-1439
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• Copper(I)-Catalyzed Stereoselective Silylative Dearomatization of Indoles and Pyrroles Using Silylboronates
  K. Hayama, R. Takahashi, K. Kubota, H. Ito, Chem. Lett., 2021, 50, 289-292
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• Silane- and Peroxide-Free Hydrogen Atom Transfer Hydrogenation Using Ascorbic Acid and Cobalt-Photoredox Dual Catalysis
  Y. Kamei, Y. Seino, Y. Yamaguchi, T. Yoshino, S. Maeda, M. Kojima, S. Matsunaga, Nat. Commun., 2021, 12, 9
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• Bright Sky-Blue Fluorescence with High Color Purity: Assembly of Luminescent Diphenyl-Anthracene Lutetium-Based Coordination Polymer
  Y. Kitagawa, A. Naito, K. Fushimi, Y. Hasegawa, RSC Advances, 2021, 11, 6604-6606
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• Stereo- and Enantioselective Synthesis of Propionate-Derived Trisubstituted Alkene Motifs
  T. Miura, N. Oku, Y. Shiratori, Y. Nagata, M. Murakami, Chem. Eur. J., 2021, 27, 3861-3868
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• Minor-Embedding Heuristics for Large-Scale Annealing Processors with Sparse Hardware Graphs of up to 102,400 Nodes
  Y. Sugie, Y. Yoshida, N. Mertig, T. Takemoto, H. Teramoto, A. Nakamura, I. Takigawa, S. I. Minato, M. Yamaoka, T. Komatsuzaki, Soft Computing, 2021, 25, 1731-1749
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• Ependymoma-like Tumor with Mesenchymal Differentiation Harboring C11orf95-NCOA1/2 or -RELA Fusion: A Hitherto Unclassified Tumor Related to Ependymoma
  R. Tomomasa, Y. Arai, R. Kawabata-Iwakawa, K. Fukuoka, Y. Nakano, N. Hama, S. Nakata, N. Suzuki, Y. Ishi, S. Tanaka, J. A. Takahashi, Y. Yuba, M. Shiota, A. Natsume, M. Kurimoto, Y. Shiba, M. Aoki, K. Nabeshima, T. Enomoto, T. Inoue, J. Fujimura, A. Kondo, T. Yao, N. Okura, T. Hirose, A. Sasaki, M. Nishiyama, K. Ichimura, T. Shibata, J. Hirato, H. Yokoo, S. Nobusawa, Brain Pathology, 2021, , 14
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• Constitutive Modeling of Bond Breaking and Healing Kinetics of Physical Polyampholyte (PA) Gel
  S. P. Venkata, K. P. Cui, J. Y. Guo, A. T. Zehnder, J. P. Gong, C. Y. Hui, Extreme Mechanics Letters, 2021, 43, 13
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• Micromechanical Modeling of the Multi-Axial Deformation Behavior in Double Network Hydrogels
  R. Xiao, T. T. Mai, K. Urayama, J. P. Gong, S. X. Qu, International Journal of Plasticity, 2021, 137, 19
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• An Information-Theoretic Approach to Infer the Underlying Interaction Domain among Elements from Finite Length Trajectories in a Noisy Environment
  U. S. Basak, S. Sattari, M. M. Hossain, K. Horikawa, T. Komatsuzaki, J. Chem. Phys., 2021, 154, 12
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• Coordination Geometrical Effect on Ligand-to-Metal Charge Transfer-Dependent Energy Transfer Processes of Luminescent Eu(III) Complexes
  P. P. F. da Rosa, S. Miyazaki, H. Sakamoto, Y. Kitagawa, K. Miyata, T. Akama, M. Kobayashi, K. Fushimi, K. Onda, T. Taketsugu, Y. Hasegawa, J. Phys. Chem. A, 2021, 125, 209-217
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• Mussel Byssus Cuticle-Inspired Ultrastiff and Stretchable Triple-Crosslinked Hydrogels
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• Catalytic Activity of Gold Clusters Supported on the h-BN/Au(111) Surface for the Hydrogen Evolution Reaction
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• Encapsulating N-Heterocyclic Carbene Binuclear Transition-Metal Complexes as a New Platform for Molecular Rotation in Crystalline Solid-State
  M. Jin, R. Ando, M. J. Jellen, M. A. Garcia-Garibay, H. Ito, J. Am. Chem. Soc., 2021, 143, 1144-1153
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• Substitution Effect on the Nonradiative Decay and Trans -> Cis Photoisomerization Route: A Guideline to Develop Efficient Cinnamate-Based Sunscreens
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• Chemoselective Cleavage of Si-C(sp(3)) Bonds in Unactivated Tetraalkylsilanes Using Iodine Tris(trifluoroacetate)
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• Regioselective 1,3-Dipolar Cycloaddition of Nitriles with Nitrile Imines Generated from Tetrazoles
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• Real-Time Probing of an Atmospheric Photochemical Reaction by Ultrashort Extreme Ultraviolet Pulses: Nitrous Acid Release from o-Nitrophenol
  Y. Nitta, O. Schalk, H. Igarashi, S. Wada, T. Tsutsumi, K. Saita, T. Taketsugu, T. Sekikawa, Journal of Physical Chemistry Letters, 2021, 12, 674-679
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• Copper-Catalyzed Reactions of Alkylboranes
  H. Ohmiya, M. Sawamura, Bulletin of the Chemical Society of Japan, 2021, 94, 197-203
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• Theoretical Method for Near-Field Raman Spectroscopy with Multipolar Hamiltonian and Real-Time-TDDFT: Application to On- and Off-Resonance Tip-Enhanced Raman Spectroscopy
  M. Takenaka, T. Taketsugu, T. Iwasa, J. Chem. Phys., 2021, 154, 14
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• Strong and Confined Acids Catalyze Asymmetric Intramolecular Hydroarylations of Unactivated Olefins with Indoles
  P. L. Zhang, N. Tsuji, J. Ouyang, B. List, J. Am. Chem. Soc., 2021, 143, 675-680
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• STATICA: A 512-Spin 0.25M-Weight Annealing Processor With an All-Spin-Updates-at-Once Architecture for Combinatorial Optimization With Complete Spin-Spin Interactions
  K. Yamamoto, K. Kawamura, K. Ando, N. Mertig, T. Takemoto, M. Yamaoka, H. Teramoto, A. Sakai, S. Takamaeda-Yamazaki, M. Motomura, Ieee Journal of Solid-State Circuits, 2021, 56, 165-178
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• Geometric Analysis of Anharmonic Downward Distortion Following Paths
  S. Ebisawa, T. Tsutsumi, T. Taketsugu, Journal of Computational Chemistry, 2021, 42, 27-39
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• Effects of Support Materials and Ir Loading on Catalytic N2O Decomposition Properties
  S. Hinokuma, T. Iwasa, Y. Kon, T. Taketsugu, K. Sato, Catalysis Communications, 2021, 149,
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• Long-Range LMCT Coupling in Eu-III Coordination Polymers for an Effective Molecular Luminescent Thermometer**
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• Lewy Pathology of the Esophagus Correlates with the Progression of Lewy Body Disease: A Japanese Cohort Study of Autopsy Cases
  Z. Tanei, Y. Saito, S. Ito, T. Matsubara, A. Motoda, M. Yamazaki, Y. Sakashita, I. Kawakami, M. Ikemura, S. Tanaka, R. Sengoku, T. Arai, S. Murayama, Acta Neuropathologica, 2021, 141, 25-37
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2020年

• Artificial Force-Induced Reaction Method for Systematic Elucidation of Mechanism and Selectivity in Organometallic Reactions
  M. Hatanaka, T. Yoshimura, S. Maeda, New Directions in the Modeling of Organometallic Reactions, 2020, 67, 57-80
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• Tough and Self-Healing Hydrogels from Polyampholytes
  T. L. Sun, K. P. Cui, Self-Healing and Self-Recovering Hydrogels, 2020, 285, 295-317
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• The Scope of 3-Acetyl-4-Hydroxy-6-Methyl-2H-Pyran-2-One (DHA)
  E. A. Ghaith, H. H. Zoorob, M. E. Ibrahim, M. Sawamura, W. S. Hamamai, Current Organic Chemistry, 2020, 24, 1459-1490
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• Topology of Pareto Sets of Strongly Convex Problems
  N. Hamada, K. Hayano, S. Ichiki, Y. Kabata, H. Teramoto, Siam Journal on Optimization, 2020, 30, 2659-2686
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• Ammonia Combustion Properties of Copper Oxides-Based Honeycomb and Granular Catalysts
  S. Hinokuma, T. Iwasa, K. Araki, Y. Kawabata, S. Matsuki, T. Sato, Y. Kon, T. Taketsugu, K. Sato, M. Machida, Journal of the Japan Petroleum Institute, 2020, 63, 274-281
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• A Bad Arm Existence Checking Problem: How to Utilize Asymmetric Problem Structure?
  K. Tabata, A. Nakamura, J. Honda, T. Komatsuzaki, Machine Learning, 2020, 109, 327-372
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• Luminescent Lanthanide Complex with Seven-Coordination Geometry
  da Rosa, PPF, Kitagawa, Y, Hasegawa, Y, Coord. Chem. Rev., 2020, 406, 9
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• Synthesis of Chiral N-Heterocyclic Allylboronates via the Enantioselective Borylative Dearomatization of Pyrroles
  K. Hayama, R. Kojima, K. Kubota, H. Ito, Org. Lett., 2020, 22, 739-744
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• Fluorescence Enhancement of Aromatic Macrocycles by Lowering Excited Singlet State Energies
  Ikemoto, K, Tokuhira, T, Uetani, A, Harabuchi, Y, Sato, S, Maeda, S, Isobe, H, J. Org. Chem., 2020, 85, 150-157
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• Splitting and Reorientation of Pi-Conjugation by an Unprecedented Photo-Rearrangement Reaction
  Inaba, Y, Yoneda, T, Kitagawa, Y, Miyata, K, Hasegawa, Y, Inokuma, Y, Chem. Commun., 2020, 56, 348-351
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• Single-Molecule Resonance Raman Effect in a Plasmonic Nanocavity
  RB. Jaculbia, H. Imada, K. Miwa, T. Iwasa, M. Takenaka, B. Yang, E. Kazuma, N. Hayazawa, T. Taketsugu, Y. Kim, Nat. Nanotechnol., 2020, 15, 105-110
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• Role of Dimerized C16orf74 in Aggressive Pancreatic Cancer: A Novel Therapeutic Target
  T. Kushibiki, T. Nakamura, M. Tsuda, T. Tsuchikawa, K. Hontani, K. Inoko, M. Takahashi, T. Asano, K. Okamura, S. Murakami, Y. Kurashima, Y. Ebihara, T. Noji, Y. Nakanishi, K. Tanaka, N. Maishi, K. Sasaki, WR. Park, T. Shichinohe, K. Hida, S. Tanaka, S. Hirano, Mol. Cancer Ther., 2020, 19, 187-198
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• Catalytic Intramolecular Coupling of Ketoalkenes by Allylic C(sp³)-H Bond Cleavage: Synthesis of Five- and Six-Membered Carbocyclic Compounds
  T. Mita, M. Uchiyama, Y. Sato, Adv. Synth. Catal., 2020, 362, 1275-1280
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• Instant Thermal Switching from Soft Hydrogel to Rigid Plastics Inspired by Thermophile Proteins
  T. Nonoyama, YW. Lee, K. Ota, K. Fujioka, W. Hong, JP. Gong, Adv. Mater., 2020, 32, 1905878
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• Trans Influence Across a Metal-Metal Bond of a Paddle-Wheel Unit on Interaction with Gases in a Metal-Organic Framework
  J. Pirillo, Y. Hijikata, Inorg. Chem., 2020, 59, 1193-1203
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• Aurophilicity-Mediated Construction of Emissive Porous Molecular Crystals as Versatile Hosts for Liquid and Solid Guests
  T. Seki, K. Ida, H. Sato, S. Aono, S. Sakaki, H. Ito, Chem. Eur. J., 2020, 26, 735-744
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• Synthesis and Tunable Optical Properties of C,N-Chelated Borate Luminophores Derived from Potassium Acyltrifluoroborates
  J. Taguchi, S. Matsuura, T. Seki, H. Ito, Chem. Eur. J., 2020, 26, 2450-2455
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• Air- and Moisture-Stable Xantphos-Ligated Palladium Dialkyl Complex as a Precatalyst for Cross-Coupling Reactions
  R. Takahashi, K. Kubota, H. Ito, Chem. Commun., 2020, 56, 407-410
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• TmQM Dataset-Quantum Geometries and Properties of 86k Transition Metal Complexes
  D. Balcells, B. B. Skjelstad, J. Chem. Inf. Model., 2020, 60, 6135-6146
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• N2O Decomposition Properties of Ru Catalysts Supported on Various Oxide Materials and SnO2
  S. Hinokuma, T. Iwasa, Y. Kon, T. Taketsugu, K. Sato, Scientific Reports, 2020, 10,
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• Modulation of Band Gaps Toward Varying Conductivities in Heterometallic One-Dimensional Chains by Ligand Alteration and Third Metal Insertion
  K. Uemura, D. Ito, J. Pirillo, Y. Hijikata, A. Saeki, Acs Omega, 2020, 5, 30502-30518
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• Convenient Synthesis of Binary and Fused Pyrazole Ring Systems: Accredited by Molecular Modeling and Biological Evaluation
  E. A. Ghaith, H. H. Zoorob, M. E. Ibrahim, M. Sawamura, W. S. Hamama, ChemistrySelect, 2020, 5, 14917-14923
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• All-Electron Relativistic Spin-Orbit Multireference Computation to Elucidate the Ground State of CeH
  Y. Kondo, Y. Goto, M. Kobayashi, T. Akama, T. Noro, T. Taketsugu, Phys. Chem. Chem. Phys., 2020, 22, 27157-27162
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• Barnacle Cement Proteins-Inspired Tough Hydrogels with Robust, Long-Lasting, and Repeatable Underwater Adhesion
  H. L. Fan, J. H. Wang, J. P. Gong, Advanced Functional Materials, 2020, ,
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• Mechanochemical Cross-Coupling Reactions
  K. Kubota, H. Ito, Trends in Chemistry, 2020, 2, 1066-1081
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• Solid-State Radical C-H Trifluoromethylation Reactions Using Ball Milling and Piezoelectric Materials
  Y. D. Pang, J. W. Lee, K. Kubota, H. Ito, Angew. Chem., Int. Ed., 2020, 59, 22570-22576
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• Phonon Transport Probed at Carbon Nanotube Yarn/sheet Boundaries by Ultrafast Structural Dynamics
  M. Hada, K. Makino, H. Inoue, T. Hasegawa, H. Masuda, H. Suzuki, K. Shirasu, T. Nakagawa, T. Seki, J. Matsuo, T. Nishikawa, Y. Yamashita, S. Koshihara, V. Stolojan, S. R. P. Silva, J. Fujita, Y. Hayashi, S. Maeda, M. Hase, Carbon, 2020, 170, 165-173
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• Bactericidal Effect of Cationic Hydrogels Prepared from Hydrophilic Polymers
  Y. Shibata, T. Kurokawa, T. Aizawa, J. P. Gong, Journal of Applied Polymer Science, 2020, 137, 10
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• A Glove-Box- and Schlenk-Line-Free Protocol for Solid-State C-N Cross-Coupling Reactions Using Mechanochemistry
  K. Kubota, R. Takahashi, M. Uesugi, H. Ito, Acs Sustainable Chemistry & Engineering, 2020, 8, 16577-16582
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• Structure of Polymer-Grafted Nanoparticle Melts
  J. Midya, M. Rubinstein, S. K. Kumar, A. Nikoubashman, Acs Nano, 2020, 14, 15505-15516
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• Stress Relaxation and Underlying Structure Evolution in Tough and Self-Healing Hydrogels
  K. P. Cui, Y. N. Ye, C. T. Yu, X. Y. Li, T. Kurokawa, J. P. Gong, ACS Macro Lett., 2020, 9, 1582-1589
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• Trapping and Releasing of Oxygen in Liquid by Metal-Organic Framework with Light and Heat
  M. Fujimura, S. Kusaka, A. Masuda, A. Hori, Y. Hijikata, J. Pirillo, Y. S. Ma, R. Matsuda, Small, 2020, ,
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• Dumbbell-Shaped 2,2 '-Bipyridines: Controlled Metal Monochelation and Application to Ni-Catalyzed Cross-Couplings
  Y. Kim, T. Iwai, S. Fujii, K. Ueno, M. Sawamura, Chem. Eur. J., 2020, ,
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• Isotope Microscopic Observation of Osteogenesis Process Forming Robust Bonding of Double Network Hydrogel to Bone
  T. Nonoyama, L. Wang, M. Tsuda, Y. Suzuki, R. Kiyama, K. Yasuda, S. Tanaka, K. Nagata, R. Fujita, N. Sakamoto, N. Kawasaki, H. Yurimoto, J. P. Gong, Advanced Healthcare Materials, 2020, ,
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• How Surface Stress Transforms Surface Profiles and Adhesion of Rough Elastic Bodies
  C. Y. Hui, Z. Z. Liu, N. Bain, A. Jagota, E. R. Dufresne, R. W. Style, R. Kiyama, J. P. Gong, Proceedings of the Royal Society a-Mathematical Physical and Engineering Sciences, 2020, 476,
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• Crystalline Naphthylene Macrocycles Capturing Gaseous Small Molecules in Chiral Nanopores
  T. Matsuno, K. Fukunaga, S. Kobayashi, P. Sarkar, S. Sato, T. Ikeda, H. Isobe, Chem. Asian J., 2020, 15, 3829-3835
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• Chiral Macrocycles HavingC(3)Symmetry Resulting from Orientation of Thiophene Rings
  T. Miura, T. Nakamuro, Y. Ishihara, Y. Nagata, M. Murakami, Angew. Chem., Int. Ed., 2020, 59, 20475-20479
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• Iridium-Catalyzed Enantioselective Transfer Hydrogenation of Ketones Controlled by Alcohol Hydrogen-Bonding and Sp(3)-C-H Noncovalent Interactions
  H. Murayama, Y. Heike, K. Higashida, Y. Shimizu, N. Yodsin, Y. Wongnongwa, S. Jungsuttiwong, S. Mori, M. Sawamura, Adv. Synth. Catal., 2020, 362, 4655-4661
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• Chitin-Based Double-Network Hydrogel as Potential Superficial Soft-Tissue-Repairing Materials
  J. C. Huang, M. Frauenlob, Y. Shibata, L. Wang, T. Nakajima, T. Nonoyama, M. Tsuda, S. Tanaka, T. Kurokawa, J. P. Gong, Biomacromolecules, 2020, 21, 4220-4230
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• First Tribo-Excited Chemical Reaction of a Stacked Lanthanide Coordination Polymer with an in Situ Reaction Monitor
  Y. Kitagawa, A. Naito, K. Fushimi, Y. Hasegawa, Chem. Eur. J., 2020, ,
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• Crack Tip Field of a Double-Network Gel: Visualization of Covalent Bond Scission through Mechanoradical Polymerization
  T. Matsuda, R. Kawakami, T. Nakajima, J. P. Gong, Macromolecules, 2020, 53, 8787-8795
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• Preparation of Tough Double- and Triple-Network Supermacroporous Hydrogels through Repeated Cryogelation
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• Effect of the Constituent Networks of Double-Network Gels on Their Mechanical Properties and Energy Dissipation Process
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• Understanding the Interactions between the Bis(trifluoromethylsulfonyl)imide Anion and Absorbed CO2 Using X-Ray Diffraction Analysis of a Soft Crystal Surrogate
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• Dependence of DNA Length on Binding Affinity between TrpR and TrpO of DNA
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• High-Fidelity Hydrogel Thin Films Processed from Deep Eutectic Solvents
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• Circularly Polarized Absorption and Luminescence of Semiconductor Eu-OCN Nanocrystals in the Blue Region of the Electromagnetic Spectrum
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• An Europium (III) Luminophore with Pressure-Sensing Units: Effective Back Energy Transfer in Coordination Polymers with Hexadentate Porous Stable Networks
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• Theoretical and Experimental Studies on the Near-Infrared Photoreaction Mechanism of a Silicon Phthalocyanine Photoimmunotherapy Dye: Photoinduced Hydrolysis by Radical Anion Generation
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• A Theoretical Study on the Alkali Metal Carboxylate-PromotedL-Lactidepolymerization
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• Supertough Lignin Hydrogels with Multienergy Dissipative Structures and Ultrahigh Antioxidative Activities
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• Kinetic Prediction of Reverse Intersystem Crossing in Organic Donor-Acceptor Molecules
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• Fiber-Reinforced Viscoelastomers Show Extraordinary Crack Resistance That Exceeds Metals
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• Chiral Lanthanide Lumino-Glass for a Circularly Polarized Light Security Device
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• Polystyrene-Cross-Linking Triphenylphosphine on a Porous Monolith: Enhanced Catalytic Activity for Aryl Chloride Cross-Coupling in Biphasic Flow
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• Polystyrene-Supported PPh(3)in Monolithic Porous Material: Effect of Cross-Linking Degree on Coordination Mode and Catalytic Activity in Pd-Catalyzed C-C Cross-Coupling of Aryl Chlorides
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• Ineffective OH Pinning of the Flipping Dynamics of a Spherical Guest Within a Tight-Fitting Tube
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• Discovery of a Synthesis Method for a Difluoroglycine Derivative Based on a Path Generated by Quantum Chemical Calculations
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• Dual Energy Transfer Pathways from an Antenna Ligand to Lanthanide Ion in Trivalent Europium Complexes with Phosphine-Oxide Bridges
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• Holding of Planar Chirality of Pillar 5 Arene by Kinetic Trapping Using Host-Guest Interactions with Achiral Guest Solvents
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• Comprehensive Analysis of Applicability Domains of QSPR Models for Chemical Reactions
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• Palladium-Catalyzed C-H Iodination of Arenes by Means of Sulfinyl Directing Groups
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• General Synthesis of Trialkyl- and Dialkylarylsilylboranes: Versatile Silicon Nucleophiles in Organic Synthesis
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• Hydrogels as Dynamic Memory with Forgetting Ability
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• Visualization of the Dynamics Effect: Projection of On-the-Fly Trajectories to the Subspace Spanned by the Static Reaction Path Network
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• Chitosan, Magnetite, Silicon Dioxide, and Graphene Oxide Nanocomposites: Synthesis, Characterization, Efficiency as Cisplatin Drug Delivery, and DFT Calculations
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• Inferring Domain of Interactions among Particles from Ensemble of Trajectories
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• Phase Separation Behavior in Tough and Self-Healing Polyampholyte Hydrogels
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• Hydrogels Toughened by Biominerals Providing Energy-Dissipative Sacrificial Bonds
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• Integrin Alpha 4 Mediates ATDC5 Cell Adhesion to Negatively Charged Synthetic Polymer Hydrogel Leading to Chondrogenic Differentiation
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• Non-Linear Rheological Study of Hydrogel Sliding Friction in Water and Concentrated Hyaluronan Solution
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• AFIR Explorations of Transition States of Extended Unsaturated Systems: Automatic Location of Ambimodal Transition States
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• Frontier Molecular Orbital Based Analysis of Solid-Adsorbate Interactions over Group 13 Metal Oxide Surfaces
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• Thermosalience in Macrocycle-Based Soft Crystals via Anisotropic Deformation of Disilanyl Architecture
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• Global Search for Crystal Structures of Carbon under High Pressure
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• Dithieno 3,4-b:3',4'-d Arsole: A Novel Class of Hetero 5 Radialenes
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• Fracture Strain of Composite with Nonuniformly Distributed Reinforcing Fibers
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• Ir-Catalyzed Reversible Acceptorless Dehydrogenation/Hydrogenation of N-Substituted and Unsubstituted Heterocycles Enabled by a Polymer-Cross-Linking Bisphosphine
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• Lamellar Bilayer to Fibril Structure Transformation of Tough Photonic Hydrogel under Elongation
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• Anisotropic Double-Network Hydrogels via Controlled Orientation of a Physical Sacrificial Network
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• Aggregation-Induced Emission of a Eu(III) Complex via Ligand-to-Metal Charge Transfer
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• Photoinduced Pyramidal Inversion Behavior of Phosphanes Involved with Aggregation-Induced Emission Behavior
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• QSAR Without Borders (vol 10, Pg 531, 2020)
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• Computational Searches for Crystal Structures of Dioxides of Group 14 Elements (CO2, SiO2, GeO2) under Ultrahigh Pressure
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• Irreverent Nature of Dissymmetry Factor and Quantum Yield in Circularly Polarized Luminescence of Small Organic Molecules
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• Double-Network Gels as Polyelectrolyte Gels with Salt-Insensitive Swelling Properties
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• Trajectory On-the-Fly Molecular Dynamics Approach to Tunneling Splitting in the Electronic Excited State: A Case of Tropolone
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• Photoluminescent Ferroelastic Molecular Crystals
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• Selective Mechanochemical Monoarylation of Unbiased Dibromoarenes by in Situ Crystallization
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• Synthetic Poly(2-Acrylamido-2-Methylpropanesulfonic Acid) Gel Induces Chondrogenic Differentiation of ATDC5 Cells via a Novel Protein Reservoir Function
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• Application of the Mol2vec Technology to Large-Size Data Visualization and Analysis
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• A Quantum Chemical Study of Substituent Effects on CN Bonds in Aryl Isocyanide Molecules Adsorbed on the Pt Surface
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• Cubane Chirality via Substitution of a "Hidden" Regular Tetrahedron
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• Characteristic Evaluation of Chameleon Luminophore Dispersed in Polymer
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• The Role of Pi-f Orbital Interactions in Eu(III) Complexes for an Effective Molecular Luminescent Thermometer
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• Modular Synthesis of Oligoacetylacetones via Site-Selective Silylation of Acetylacetone Derivatives
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• Development of Copper-Catalyzed Chemoselective Reactions
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• Rate Constant Matrix Contraction Method for Systematic Analysis of Reaction Path Networks
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• Phase Separation Driven by Production of Architectural RNA Transcripts
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• Chiral Monolayers with Achiral Tetrapod Molecules on Highly Oriented Pyrolytic Graphite
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• Fabrication of Bioinspired Hydrogels: Challenges and Opportunities
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• Cisplatin Relocalizes RNA Binding Protein HuR and Enhances the Oncolytic Activity of E4orf6 Deleted Adenovirus
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• Mesoscale Bicontinuous Networks in Self-Healing Hydrogels Delay Fatigue Fracture
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• Supramolecular Conformational Control of Aliphatic Oligoketones by Rotaxane Formation
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• Migrations and Catalytic Action of Water Molecules in the Ionized Formamide-(H2O)(2) Cluster
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• Combined Computational Quantum Chemistry and Classical Electrodynamics Approach for Surface Enhanced Infrared Absorption Spectroscopy
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• Electronic Strain Effect on Eu(III) Complexes for Enhanced Circularly Polarized Luminescence
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• Signaling Adaptor Protein Crk Is Involved in Malignant Feature of Pancreatic Cancer Associated with Phosphorylation of c-Met
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• Copper(I)-Catalyzed Boryl Substitution of 1-Trifluoromethyl Allenes for the Synthesis of 3-Boryl-Substituted 1,1-Gem-Difluorodienes
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• First Demonstration of the Pi-f Orbital Interaction Depending on the Coordination Geometry in Eu(III) Luminophores
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• Steric and Electronic Control of Chiral Eu(III) Complexes for Effective Circularly Polarized Luminescence
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• Copper-Catalyzed Enantioselective Conjugate Reduction of Alpha,beta-Unsaturated Esters with Chiral Phenol-Carbene Ligands
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• Luminescent Coordination Polymers Constructed from a Flexible, Tetradentate Diisopyrazole Ligand and Copper(I) Halides
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• Effect of Relative Strength of Two Networks on the Internal Fracture Process of Double Network Hydrogels As Revealed by in Situ Small-Angle X-Ray Scattering
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• Mechanical Behavior of Unidirectional Fiber Reinforced Soft Composites
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• Silyl-Group-Directed Linear-Selective Allylation of Carbonyl Compounds with Trisubstituted Allylboronates Using a Copper(I) Catalyst
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• First Aggregation-Induced Emission of a Tb(III) Luminophore Based on Modulation of Ligand-Ligand Charge Transfer Bands
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• Observations and Theories of Quantum Effects in Proton Transfer Electrode Processes
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• Crystal Jumping of Simple Hydrocarbons: Cooling-Induced Salient Effect of Bis-, Tri-, and Tetraphenylethene through Anisotropic Lattice Dimension Changes Without Thermal Phase Transitions
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• Mixed Crystal Formation of Two Gold Isocyanide Complexes with Various Ratios for Continuous Tuning of Photophysical Properties
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• Machine Learning for Catalysis Informatics: Recent Applications and Prospects
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• Stacked Nanocarbon Photosensitizer for Efficient Blue Light Excited Eu(III) Emission
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  DOI: 10.1038/s42004-019-0251-z
  

2019年

• Raman Spectroscopic Histology Using Machine Learning for Nonalcoholic Fatty Liver Disease
  KM. Helal, JN. Taylor, H. Cahyadi, A. Okajima, K. Tabata, Y. Itoh, H. Tanaka, K. Fujita, Y. Harada, T. Komatsuzaki, Febs Letters, 2019, 593, 2535-2544
  DOI: 10.1002/1873-3468.13520
  
• Adjacent Cationic–aromatic Sequences Yield Strong Electrostatic Adhesion of Hydrogels in Seawater
  HL. Fan, JH. Wang, Z. Tao, JC. Huang, P. Rao, T. Kurokawa, JP. Gong, Nat. Commun., 2019, 10, 5127
  DOI: 10.1038/s41467-019-13171-9
  
• Catalytic Enantioselective Synthesis of Allylic Boronates Bearing a Trisubstituted Alkenyl Fluoride and Related Derivatives
  Akiyama, S, Kubota, K, Mikus, MS, Paioti, PHS, Romiti, F, Liu, QH, Zhou, YB, Hoveyda, AH, H. Ito, Angew. Chem., Int. Ed., 2019, 58, 11998-12003
  DOI: 10.1002/anie.201906283
  
• Dependence of Absorption and Emission Spectra on Polymorphs of Gold(I) Isocyanide Complexes: Theoretical Study with QM/MM Approach
  S. Aono, T. Seki, H. Ito, S. Sakaki, J. Phys. Chem. C, 2019, 123, 4773-4794
  DOI: 10.1021/acs.jpcc.8b10602
  
• A Polystyrene-Cross-Linking Tricyclohexylphosphine: Synthesis, Characterization and Applications to Pd-Catalyzed Cross-Coupling Reactions of Aryl Chlorides
  Arashima, J, Iwai, T, Sawamura, M, Chem. Asian J., 2019, 14, 411-415
  DOI: 10.1002/asia.201801651
  
• Control over Coordination Self-Assembly of Flexible, Multidentate Ligands by Stepwise Metal Coordination of Isopyrazole Subunits
  Y. Ashida, Y. Manabe, S. Yoshioka, T. Yoneda, Y. Inokuma, Dalton Trans., 2019, 48, 818-822
  DOI: 10.1039/c8dt04935a
  
• Facile Synthesis of Novel Elastomers with Tunable Dynamics for Toughness, Self-Healing and Adhesion
  L. Chen, TL. Sun, KP. Cui, DR. King, T. Kurokawa, Y. Saruwatari, JP. Gong, J. Mater. Chem. A, 2019, 7, 17334-17344
  DOI: 10.1039/c9ta04840e
  
• CO₂ Adsorption on Ti₃O₆^-: A Novel Carbonate Binding Motif
  S. Debnath, XW. Song, MR. Fagiani, ML. Weichman, M. Gao, S. Maeda, T. Taketsugu, W. Schollkopf, A. Lyalin, DM. Neumark, KR. Asmis, J. Phys. Chem. C, 2019, 123, 8439-8446
  DOI: 10.1021/acs.jpcc.8b10724
  
• Low-Lying Excited States of HqxcH and Zn-Hqxc Complex: Toward Understanding Intramolecular Proton Transfer Emission
  M. Ebina, Y. Kondo, T. Iwasa, T. Taketsugu, Inorg. Chem., 2019, 58, 4686-4698
  DOI: 10.1021/acs.inorgchem.9b00410
  
• Modulation and Characterization of the Double Network Hydrogel Surface-Bulk Transition
  M. Frauenlob, DR. King, HL. Guo, S. Ishihara, M. Tsuda, T. Kurokawa, H. Haga, S. Tanaka, JP. Gong, Macromolecules, 2019, 52, 6704-6713
  DOI: 10.1021/acs.macromol.9b01399
  
• Internal Damage Evolution in Double-Network Hydrogels Studied by Microelectrode Technique
  HL. Guo, W. Hong, T. Kurokawa, T. Matsuda, ZL. Wu, T. Nakajima, M. Takahata, TL. Sun, P. Rao, JP. Gong, Macromolecules, 2019, 52, 7114-7122
  DOI: 10.1021/acs.macromol.9b01308
  
• Hydrophobic Hydrogels with Fruit-Like Structure and Functions
  H. Guo, T. Nakajima, D. Hourdet, A. Marcellan, C. Creton, W. Hong, T. Kurokawa, JP. Gong, Adv. Mater., 2019, 31, 1900702
  DOI: 10.1002/adma.201900702
  
• One-Minute Joule Annealing Enhances the Thermoelectric Properties of Carbon Nanotube Yarns via the Formation of Graphene at the Interface
  M. Hada, T. Hasegawa, H. Inoue, M. Takagi, K. Omoto, D. Chujo, S. Iemoto, T. Kuroda, T. Morimoto, T. Hayashi, T. Iijima, T. Tokunaga, N. Ikeda, K. Fujimori, C. Itoh, T. Nishikawa, Y. Yamashita, T. Kiwa, S. Koshihara, S. Maeda, Y. Hayashi, ACS Appl. Energy Mater., 2019, 2, 7700-7708
  DOI: 10.1021/acsaem.9b01736
  
• Anharmonic Vibrational Computations with a Quartic Force Field for Curvilinear Coordinates
  Y. Harabuchi, R. Tani, N. De Silva, B. Njegic, MS. Gordon, T. Taketsugu, J. Chem. Phys., 2019, 151, 064104
  DOI: 10.1063/1.5096167
  
• Thermo-Sensitive Luminescence of Lanthanide Complexes, Clusters, Coordination Polymers and Metal-Organic Frameworks with Organic Photosensitizers
  Y. Hasegawa, Y. Kitagawa, J. Mater. Chem. C, 2019, 7, 7494-7511
  DOI: 10.1039/c9tc00607a
  
• Near-IR Luminescent Yb^III Coordination Polymers Composed of Pyrene Derivatives for Thermostable Oxygen Sensors
  Y. Hasegawa, T. Matsui, Y. Kitagawa, T. Nakanishi, T. Seki, H. Ito, Y. Nakasaka, T. Masuda, K. Fushimi, Chem. Eur. J., 2019, 25, 12308-12315
  DOI: 10.1002/chem.201902583
  
• Thermal and Crystallographic Investigation of Luminescent Eu(III) Coordination Polymers with Dithiane and Dioxane Hexyl Rings
  Y. Hirai, PPF. da Rosa, Y. Kitagawa, Y. Hasegawa, Chem. Lett., 2019, 48, 1544-1546
  DOI: 10.1246/cl.190752
  
• Lifetimes of Lanthanide(III) Triboluminescence Excited by Aerodynamic Shock Waves
  Y. Hirai, A. Kotani, H. Sakaue, Y. Kitagawa, Y. Hasegawa, J. Phys. Chem. C, 2019, 123, 27251-27256
  DOI: 10.1021/acs.jpcc.9b08349
  
• Superior Fracture Resistance of Fiber Reinforced Polyampholyte Hydrogels Achieved by Extraordinarily Large Energy-Dissipative Process Zones
  YW. Huang, DR. King, W. Cui, TL. Sun, HL. Guo, T. Kurokawa, HR. Brown, CY. Hui, JP. Gong, J. Mater. Chem. A, 2019, 7, 13431-13440
  DOI: 10.1039/c9ta02326g
  
• Asymmetric Synthesis of α-Alkylidene-β-Lactams Through Copper Catalysis with a Prolinol-Phosphine Chiral Ligand
  K. Imai, Y. Takayama, H. Murayama, H. Ohmiya, Y. Shimizu, M. Sawamura, Org. Lett., 2019, 21, 1717-1721
  DOI: 10.1021/acs.orglett.9b00276
  
• Aliphatic Polyketones as Shapable Molecular Chains
  Y. Inokuma, J. Syn. Org. Chem. Jpn., 2019, 77, 1078-1085
  DOI: 10.5059/yukigoseikyokaishi.77.1078
  
• Microphase Separation of Carbohydrate-Based Star-Block Copolymers with Sub-10 nm Periodicity
  T. Isono, N. Kawakami, K. Watanabe, K. Yoshida, I. Otsuka, H. Mamiya, H. Ito, T. Yamamoto, K. Tajima, R. Borsali, T. Satoh, Polym. Chem., 2019, 10, 1119-1129
  DOI: 10.1039/c8py01745j
  
• Copper(I)-Catalyzed Enantioconvergent Borylation of Racemic Benzyl Chlorides Enabled by Quadrant-by-Quadrant Structure Modification of Chiral Bisphosphine Ligands
  H. Iwamoto, K. Endo, Y. Ozawa, Y. Watanabe, K. Kubota, T. Imamoto, H. Ito, Angew. Chem., Int. Ed., 2019, 58, 11112-11117
  DOI: 10.1002/anie.201906011
  
• Combined Automated Reaction Pathway Searches and Sparse Modeling Analysis for Catalytic Properties of Lowest Energy Twins of Cu₁₃
  T. Iwasa, T. Sato, M. Takagi, M. Gao, A. Lyalin, M. Kobayashi, K. Shimizu, S. Maeda, T. Taketsugu, J. Phys. Chem. A, 2019, 123, 210-217
  DOI: 10.1021/acs.jpca.8b08868
  
• Anisotropic Thermal Expansion as the Source of Macroscopic and Molecular Scale Motion in Phosphorescent Amphidynamic Crystals
  M. Jin, S. Yamamoto, T. Seki, H. Ito, MA. Garcia-Garibay, Angew. Chem., Int. Ed., 2019, 58, 18003-18010
  DOI: 10.1002/anie.201909048
  
• Linear Correlations Between Adsorption Energies and HOMO Levels for the Adsorption of Small Molecules on TiO₂ Surfaces
  T. Kamachi, T. Tatsumi, T. Toyao, Y. Hinuma, Z. Maeno, S. Takakusagi, S. Furukawa, I. Takigawa, K. Shimizu, J. Phys. Chem. C, 2019, 123, 20988-20997
  DOI: 10.1021/acs.jpcc.9b05707
  
• Macroscale Double Networks: Design Criteria for Optimizing Strength and Toughness
  DR. King, T. Okumura, R. Takahashi, T. Kurokawa, JP. Gong, ACS Appl. Mater. Interfaces, 2019, 11, 35343-35353
  DOI: 10.1021/acsami.9b12935
  
• The Direct Observation of the Doorway ¹nπ* State of Methylcinnamate and Hydrogen-Bonding Effects on the Photochemistry of Cinnamate-Based Sunscreens
  S. Kinoshita, Y. Inokuchi, Y. Onitsuka, H. Kohguchi, N. Akai, T. Shiraogawa, M. Ehara, K. Yamazaki, Y. Harabuchi, S. Maeda, T. Ebata, Phys. Chem. Chem. Phys., 2019, 21, 19755-19763
  DOI: 10.1039/c9cp02914a
  
• Redox Reactions of Small Organic Molecules Using Ball Milling and Piezoelectric Materials
  K. Kubota, YD. Pang, A. Miura, H. Ito, Science, 2019, 366, 1500-1504
  DOI: 10.1126/science.aay8224
  
• Olefin-Accelerated Solid-State C-N Cross-Coupling Reactions Using Mechanochemistry
  K. Kubota, T. Seo, K. Koide, Y. Hasegawa, H. Ito, Nat. Commun., 2019, 10,
  DOI: 10.1038/s41467-018-08017-9
  
• Mechanochemistry Allows Carrying out Sensitive Organometallic Reactions in Air: Glove-Box-and-Schlenk-Line-Free Synthesis of Oxidative Addition Complexes from Aryl Halides and Palladium(0)
  K. Kubota, R. Takahashi, H. Ito, Chem. Sci., 2019, 10, 5837-5842
  DOI: 10.1039/c9sc01711a
  
• Synthesis of 2-Alkyl-2-Boryl-Substituted-Tetrahydrofurans via Copper(I)-Catalysed Borylative Cyclization of Aliphatic Ketones
  K. Kubota, M. Uesugi, S. Osaki, H. Ito, Org. Biomol. Chem., 2019, 17, 5680-5683
  DOI: 10.1039/c9ob00962k
  
• Dynamic Topochemical Reaction Tuned by Guest Molecules in the Nanospace of a Metal-Organic Framework
  S. Kusaka, A. Kiyose, H. Sato, Y. Hijikata, A. Hori, YS. Ma, R. Matsuda, J. Am. Chem. Soc., 2019, 141, 15742-15746
  DOI: 10.1021/jacs.9b07682
  
• Soft X-Ray Li-K and Si-L_2,3 Emission from Crystalline and Amorphous Lithium Silicides in Lithium-Ion Batteries Anode
  A. Lyalin, VG. Kuznetsov, A. Nakayama, IV. Abarenkov, II. Tupitsyn, IE. Gabis, K. Uosaki, T. Taketsugu, J. Electrochem. Soc., 2019, 166, A5362-A5368
  DOI: 10.1149/2.0551903jes
  
• On Benchmarking of Automated Methods for Performing Exhaustive Reaction Path Search
  S. Maeda, Y. Harabuchi, J. Chem. Theory Comput., 2019, 15, 2111-2115
  DOI: 10.1021/acs.jctc.8b01182
  
• Damage Cross-Effect and Anisotropy in Tough Double Network Hydrogels Revealed by Biaxial Stretching
  TT. Mai, T. Matsuda, T. Nakajima, JP. Gong, K. Urayama, Soft Matter, 2019, 15, 3719-3732
  DOI: 10.1039/c9sm00409b
  
• Two-Step Transformation of Aliphatic Polyketones into π-Conjugated Polyimines
  Y. Manabe, M. Uesaka, T. Yoneda, Y. Inokuma, J. Org. Chem., 2019, 84, 9957-9964
  DOI: 10.1021/acs.joc.9b01119
  
• Fabrication of Tough and Stretchable Hybrid Double-Network Elastomers Using Ionic Dissociation of Polyelectrolyte in Nonaqueous Media
  T. Matsuda, T. Nakajima, JP. Gong, Chem. Mater., 2019, 31, 3766-3776
  DOI: 10.1021/acs.chemmater.9b00871
  
• Boron-Catalyzed Alpha-Amination of Carboxylic Acids
  T. Morisawa, M. Sawamura, Y. Shimizu, Org. Lett., 2019, 21, 7466-7469
  DOI: 10.1021/acs.orglett.9b02769
  
• Polyelectrolyte Complexation via Viscoelastic Phase Separation Results in Tough and Self-Recovering Porous Hydrogels
  K. Murakawa, DR. King, TL. Sun, HL. Guo, T. Kurokawa, JP. Gong, J. Mater. Chem. B, 2019, 7, 5296-5305
  DOI: 10.1039/c9tb01376h
  
• Tough Double Network Elastomers Reinforced by the Amorphous Cellulose Network
  J. Murat, T. Nakajima, T. Matsuda, K. Tsunoda, T. Nonoyama, T. Kurokawa, JP. Gong, Polymer, 2019, 178, 121686
  DOI: 10.1016/j.polymer.2019.121686
  
• Divergent Dynamics and Functions of ERK MAP Kinase Signaling in Development, Homeostasis and Cancer: Lessons from Fluorescent Bioimaging
  Y. Muta, M. Tsuda, M. Imajo, Cancers, 2019, 11, 513
  DOI: 10.3390/cancers11040513
  
• Tough Double-Network Gels and Elastomers from the Nonprestretched First Network
  T. Nakajima, Y. Ozaki, R. Namba, K. Ota, Y. Maida, T. Matsuda, T. Kurokawa, JP. Gong, ACS Macro Lett., 2019, 8, 1407-1412
  DOI: 10.1021/acsmacrolett.9b00679
  
• Nickel-Catalyzed Decarboxylation of Aryl Carbamates for Converting Phenols into Aromatic Amines
  A. Nishizawa, T. Takahira, K. Yasui, H. Fujimoto, T. Iwai, M. Sawamura, N. Chatani, M. Tobisu, J. Am. Chem. Soc., 2019, 141, 7261-7265
  DOI: 10.1021/jacs.9b02751
  
• A Theoretical Study on the Mechanism of the Oxidative Deborylation/C-C Coupling Reaction of Borepin Derivatives
  C. Ozen, Y. Shoji, T. Fukushima, S. Maeda, J. Org. Chem., 2019, 84, 1941-1950
  DOI: 10.1021/acs.joc.8b02917
  
• Iridium(I)-Catalyzed C-H Borylation in Air by Using Mechanochemistry
  YD. Pang, T. Ishiyama, K. Kubota, H. Ito, Chem. Eur. J., 2019, 25, 4654-4659
  DOI: 10.1002/chem.201900685
  
• Programmed Diffusion Induces Anisotropic Superstructures in Hydrogels with High Mechano-Optical Sensitivity
  LC. Qiao, C. Du, JP. Gong, ZL. Wu, Q. Zheng, Adv. Mater. Technol., 2019, 4, 1900665
  DOI: 10.1002/admt.201900665
  
• Carbohelicenes and Thiahelicene from Phthalaldehydes Through Perkin Approach
  P. Sarkar, BK. Das, D. Chakraborty, K. Muthamma, J. Mol. Struc., 2019, 1195, 309-314
  DOI: 10.1016/j.molstruc.2019.05.118
  
• Topological Molecular Nanocarbons: All-Benzene Catenane and Trefoil Knot
  Y. Segawa, M. Kuwayama, Y. Hijikata, M. Fushimi, T. Nishihara, J. Pirillo, J. Shirasaki, N. Kubota, K. Itami, Science, 2019, 365, 272-276
  DOI: 10.1126/science.aav5021
  
• Luminescent Mechanochromism of Gold N-Heterocyclic Carbene Complexes with Hypso- and Bathochromic Spectral Shifts
  T. Seki, K. Kashiyama, H. Ito, Dalton Trans., 2019, 48, 7105-7109
  DOI: 10.1039/c9dt00566h
  
• Anisotropic Strain Release in a Thermosalient Crystal: Correlation Between the Microscopic Orientation of Molecular Rearrangements and the Macroscopic Mechanical Motion
  T. Seki, T. Mashimo, H. Ito, Chem. Sci., 2019, 10, 4185-4191
  DOI: 10.1039/c8sc05563g
  
• Solid-State Suzuki-Miyaura Cross-Coupling Reactions: Olefin-Accelerated C-C Coupling Using Mechanochemistry
  T. Seo, T. Ishiyama, K. Kubota, H. Ito, Chem. Sci., 2019, 10, 8202-8210
  DOI: 10.1039/c9sc02185j
  
• Photoluminescence Properties of [Core plus exo]-Type Au-6 Clusters: Insights into the Effect of Ligand Environments on the Excitation Dynamics
  Y. Shichibu, MZ. Zhang, T. Iwasa, Y. Ono, T. Taketsugu, S. Omagari, T. Nakanishi, Y. Hasegawa, K. Konishi, J. Phys. Chem. C, 2019, 123, 6934-6939
  DOI: 10.1021/acs.jpcc.9b01810
  
• One-Step Synthesis of an Adaptive Nanographene MOF: Adsorbed Gas-Dependent Geometrical Diversity
  S. Suginome, H. Sato, A. Hori, A. Mishima, Y. Harada, S. Kusaka, R. Matsuda, J. Pirillo, Y. Hijikata, T. Aida, J. Am. Chem. Soc., 2019, 141, 15649-15655
  DOI: 10.1021/jacs.9b07732
  
• Understanding CO Oxidation on the Pt(111) Surface Based on a Reaction Route Network
  K. Sugiyama, Y. Sumiya, M. Takagi, K. Saita, S. Maeda, Phys. Chem. Chem. Phys., 2019, 21, 14366-14375
  DOI: 10.1039/c8cp06856a
  
• Roles of Closed-and Open-Loop Conformations in Large-Scale Structural Transitions of L-Lactate Dehydrogenase
  K. Suzuki, S. Maeda, K. Morokuma, Acs Omega, 2019, 4, 1178-1184
  DOI: 10.1021/acsomega.8b02813
  
• Statistical Analysis and Discovery of Heterogeneous Catalysts Based on Machine Learning from Diverse Published Data
  K. Suzuki, T. Toyao, Z. Maeno, S. Takakusagi, K. Shimizu, I. Takigawa, Chemcatchem, 2019, 11, 4537-4547
  DOI: 10.1002/cctc.201900971
  
• Concise Synthesis of Potassium Acyltrifluoroborates from Aldehydes Through Copper(I)-Catalyzed Borylation/Oxidation
  J. Taguchi, T. Takeuchi, R. Takahashi, F. Masero, H. Ito, Angew. Chem., Int. Ed., 2019, 58, 7299-7303
  DOI: 10.1002/anie.201901748
  
• Double Network Hydrogels Based on Semi-Rigid Polyelectrolyte Physical Networks
  R. Takahashi, T. Ikai, T. Kurokawa, DR. King, JP. Gong, J. Mater. Chem. B, 2019, 7, 6347-6354
  DOI: 10.1039/c9tb01217f
  
• Ab Initio Surface Hopping Molecular Dynamics on the Dissociative Recombination of CH₃⁺
  T. Taketsugu, Y. Kobayashi, Comput. Theor. Chem, 2019, 1150, 1-9
  DOI: 10.1016/j.comptc.2019.01.010
  
• Additive-Dependent Iptycene Incorporation in Polyanilines: Insights into the Pentiptycene Clipping Effect and the Polymerization Mechanism
  WS. Tan, TY. Lee, SF. Tseng, YF. Hsu, M. Ebina, T. Taketsugu, SJ. Huang, JS. Yang, J. Chin. Chem. Soc., 2019, 66, 1141-1156
  DOI: 10.1002/jccs.201900194
  
• Autopsy Findings in the Early Stage of Amyotrophic Lateral Sclerosis with "Dropped Head" Syndrome
  S. Tanikawa, M. Tanino, L. Wang, M. Ishikawa, M. Miyazaki, M. Tsuda, Y. Orba, H. Sawa, K. Matoba, N. Nakamura, K. Nagashima, WW. Hall, S. Tanaka, Neuropathology, 2019, 39, 374-377
  DOI: 10.1111/neup.12583
  
• Fabrication of Tough Hydrogel Composites from Photoresponsive Polymers to Show Double-Network Effect
  Z. Tao, HL. Fan, JC. Huang, TL. Sun, T. Kurokawa, JP. Gong, ACS Appl. Mater. Interfaces, 2019, 11, 37139-37146
  DOI: 10.1021/acsami.9b13746
  
• High-Resolution Raman Microscopic Detection of Follicular Thyroid Cancer Cells with Unsupervised Machine Learning
  JN. Taylor, K. Mochizuki, K. Hashimoto, Y. Kumamoto, Y. Harada, K. Fujita, T. Komatsuzaki, J. Phys. Chem. B, 2019, 123, 4358-4372
  DOI: 10.1021/acs.jpcb.9b01159
  
• Roles of Silver Nanoclusters in Surface-Enhanced Raman Spectroscopy
  T. Tsuneda, T. Iwasa, T. Taketsugu, J. Chem. Phys., 2019, 151, 094102
  DOI: 10.1063/1.5111944
  
• Nickel-Copper-Catalyzed Hydroacylation of Vinylarenes with Acyl Fluorides and Hydrosilanes
  Y. Ueda, T. Iwai, M. Sawamura, Chem. Eur. J., 2019, 25, 9410-9414
  DOI: 10.1002/chem.201900822
  
• Single-Phase Borophene on Ir(111): Formation, Structure, and Decoupling from the Support
  NA. Vinogradov, A. Lyalin, T. Taketsugu, AS. Vinogradov, A. Preobrajenski, Acs Nano, 2019, 13, 14511-14518
  DOI: 10.1021/acsnano.9b08296
  
• Heterogeneous Nickel-Catalyzed Cross-Coupling Between Aryl Chlorides and Alkyllithiums Using a Polystyrene-Cross-Linking Bisphosphine Ligand
  Y. Yamazaki, N. Arima, T. Iwai, M. Sawamura, Adv. Synth. Catal., 2019, 361, 2250-2254
  DOI: 10.1002/adsc.201801713
  
• Shearing-Induced Contact Pattern Formation in Hydrogels Sliding in Polymer Solution
  S. Yashima, S. Hirayama, T. Kurokawa, T. Salez, H. Takefuji, W. Hong, JP. Gong, Soft Matter, 2019, 15, 1953-1959
  DOI: 10.1039/c8sm02428f
  
• Relaxation Dynamics and Underlying Mechanism of a Thermally Reversible Gel from Symmetric Triblock Copolymer
  YN. Ye, KP. Cui, T. Indei, T. Nakajima, D. Hourdet, T. Kurokawa, JP. Gong, Macromolecules, 2019, 52, 8651-8661
  DOI: 10.1021/acs.macromol.9b01856
  
• Zn(OTf)₂-Mediated Annulations of N-Propargylated Tetrahydrocarbolines: Divergent Synthesis of Four Distinct Alkaloidal Scaffolds
  S. Yorimoto, A. Tsubouchi, H. Mizoguchi, H. Oikawa, Y. Tsunekawa, T. Ichino, S. Maeda, H. Oguri, Chem. Sci., 2019, 10, 5686-5698
  DOI: 10.1039/c9sc01507h
  
• Exosomes Containing ErbB2/CRK Induce Vascular Growth in Premetastatic Niches and Promote Metastasis of Bladder Cancer
  K. Yoshida, M. Tsuda, R. Matsumoto, S. Semba, L. Wang, H. Sugino, M. Tanino, T. Kondo, K. Tanabe, S. Tanaka, Cancer Sci., 2019, 110, 2119-2132
  DOI: 10.1111/cas.14080
  
• Conjugated Quantitative Structure-Property Relationship Models: Application to Simultaneous Prediction of Tautomeric Equilibrium Constants and Acidity of Molecules
  DV. Zankov, TI. Madzhidov, A. Rakhimbekova, TR. Gimadiev, RI. Nugmanov, MA. Kazymova, II. Baskin, A. Varnek, J. Chem. Inf. Model., 2019, 59, 4569-4576
  DOI: 10.1021/acs.jcim.9b00722
  
• Iridium-Catalyzed Alkene-Selective Transfer Hydrogenation with 1,4-Dioxane as Hydrogen Donor
  DL. Zhang, T. Iwai, M. Sawamura, Org. Lett., 2019, 21, 5867-5872
  DOI: 10.1021/acs.orglett.9b01989