業績一覧

2020年

2020年

  • Aggregation-Induced Emission of a Eu(III) Complex via Ligand-to-Metal Charge Transfer
    Y. Kitagawa, M. Kumagai, K. Fushimi, Y. Hasegawa, Chemical Physics Letters, 2020, 749, 4
    DOI: 10.1016/j.cplett.2020.137437
  • Photoinduced Pyramidal Inversion Behavior of Phosphanes Involved with Aggregation-Induced Emission Behavior
    T. Machida, T. Iwasa, T. Taketsugu, K. Sada, K. Kokado, Chem. Eur. J., 2020, 26, 8028-8034
    DOI: 10.1002/chem.202000264
  • QSAR Without Borders (vol 10, Pg 531, 2020)
    E. N. Muratov, J. Bajorath, R. P. Sheridan, I. V. Tetko, D. Filimonov, V. Poroikov, T. I. Oprea, I. Baskin, A. Varnek, A. Roitberg, O. Isayev, S. Curtarolo, D. Fourches, Y. Cohen, A. Aspuru-Guzik, D. A. Winkler, D. Agrafiotis, A. Cherkasov, A. Tropsha, Chemical Society Reviews, 2020, 49, 3716-3716
    DOI: 10.1039/d0cs90041a
  • Computational Searches for Crystal Structures of Dioxides of Group 14 Elements (CO2, SiO2, GeO2) under Ultrahigh Pressure
    H. Nabata, M. Takagi, K. Saita, S. Maeda, RSC Advances, 2020, 10, 22156-22163
    DOI: 10.1039/d0ra03359f
  • Irreverent Nature of Dissymmetry Factor and Quantum Yield in Circularly Polarized Luminescence of Small Organic Molecules
    Y. Nagata, T. Mori, Frontiers in Chemistry, 2020, 8, 6
    DOI: 10.3389/fchem.2020.00448
  • Double-Network Gels as Polyelectrolyte Gels with Salt-Insensitive Swelling Properties
    T. Nakajima, T. Chida, K. Mito, T. Kurokawa, J. P. Gong, Soft Matter, 2020, 16, 5487-5496
    DOI: 10.1039/d0sm00605j
  • Trajectory On-the-Fly Molecular Dynamics Approach to Tunneling Splitting in the Electronic Excited State: A Case of Tropolone
    Y. Ootani, A. Satoh, Y. Harabuchi, T. Taketsugu, Journal of Computational Chemistry, 2020, 41, 1549-1556
    DOI: 10.1002/jcc.26199
  • Photoluminescent Ferroelastic Molecular Crystals
    T. Seki, C. Feng, K. Kashiyama, S. Sakamoto, Y. Takasaki, T. Sasaki, S. Takamizawa, H. Ito, Angew. Chem., Int. Ed., 2020, 59, 8839-8843
    DOI: 10.1002/anie.201914610
  • Selective Mechanochemical Monoarylation of Unbiased Dibromoarenes by in Situ Crystallization
    T. Seo, K. Kubota, H. Ito, J. Am. Chem. Soc., 2020, 142, 9884-9889
    DOI: 10.1021/jacs.0c01739
  • Synthetic Poly(2-Acrylamido-2-Methylpropanesulfonic Acid) Gel Induces Chondrogenic Differentiation of ATDC5 Cells via a Novel Protein Reservoir Function
    S. Semba, N. Kitamura, M. Tsuda, K. Goto, S. Kurono, Y. Ohmiya, T. Kurokawa, J. P. Gong, K. Yasuda, S. Tanaka, Journal of Biomedical Materials Research Part A, 2020, ,
    DOI: 10.1002/jbm.a.37028
  • Application of the Mol2vec Technology to Large-Size Data Visualization and Analysis
    S. Shibayama, G. Marcou, D. Horvath, I. Baskin, K. Funatsu, A. Varnek, Molecular Informatics, 2020, 39, 10
    DOI: 10.1002/minf.201900170
  • A Quantum Chemical Study of Substituent Effects on CN Bonds in Aryl Isocyanide Molecules Adsorbed on the Pt Surface
    B. Wang, M. Gao, K. Uosaki, T. Taketsugu, Phys. Chem. Chem. Phys., 2020, 22, 12200-12208
    DOI: 10.1039/d0cp00760a