研究领域

Computational Chemistry & Chemical Education

Developement of integrated GUI for 3D-molecular modelling, visualization of quantum chemical calculation, and generation of GAMESS FMO (Fragment MO) input file. Theoretical study of molecular interaction of large systems, like protein, using GAMESS FMO method. keyword : molecular model, software, OpenGL, GAMESS, FMO, Fragment MO 2001.04. Study of inclusion phenomina of cucurbit[5]uril with gas molecule keyword : inclusion supermolecule 2000.04～2001.03.

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Mariappan Mariappan, Masahiko Suenaga, Abhik Mukhopadhyay, Pallepogu Raghavaih, and Bhaskar G. Maiya,Synthesis, structure, DNA binding and photocleavage activity of a ruthenium(II) complex with 11-(9-acridinyl)dipyrido[3,2-a:2',3'-c]phenazine ligand,Inorganica Chimica Acta,Vol.376,pp.340,2011.08. Kikuko Hayamizu, Seiji Tsuzuki, Shiro Seki, Kenta Fujii, Masahiko Suenaga, and Yasuhiro Umebayashi,Studies on the translational and rotational motions of ionic liquids composed of N-methyl-N-propyl-pyrrolidinium (P13) cation and bis(trifluoromethanesulfonyl)amide and bis(fluorosulfonyl)amide anions and their binary systems including lithium salts,The Journal of Chemical Physics,Vol.133,pp.194505,2010.11. M. Shibahara, M. Watanabe, M. Suenaga, K. Ideta, T. Matsumoto, and T. Shinmyozu,A Conformational Study of [3.3](3,5)Pyridinophane,Tetrahedron Letters,Vol.50,pp.1340,2009.03. Facio: New Computational Chemistry Environment for PC GAMESS M. Suenaga, Journal of Computer Chemistry, Japan, Vol. 4, No. 1 pp. 25-32 (2005). The Model Of A Supermolecule With Dodecahedral Symmetry M. Suenaga, Journal of Computer Chemistry, Japan, Vol. 3, No. 1 pp.27-34 (2004). Development Of A Server/Client Type Reagent Management System (Servo) Using PostgreSQL As A Database M. Suenaga, Journal of Computer Chemistry, Japan, Vol. 2, No. 1 pp.41-48 (2003). Y. Miyahara, Y. Tanaka, K. Amimoto, T. Akazawa, T. Sakuragi, H. Kobayashi, K. Kubota, M. Suenaga, H. Koyama, and T. Inazu,The Proton Cryptate of Hexaethylenetetramine,Angew. Chem. Int. Ed.,Vol.38,No.7,38, 956-959 (1999),1999.04. A. A. Ibrahim, M. Matsumoto, Y. Miyahara, K. Izumi, M. Suenaga, N. Shimizu, and T. Inazu,Synthesis and Properties of a New Series of Troegaropnanes,J. Heterocyclic Chem.,Vol.35,No.1,35, 209-215 (1998),1998.01. M. Suenaga, Y. Miyahara, N. Shimizu, and T. Inazu,Synthesis of the Trinaphthophenalenium Cation,Angew. Chem. Int. Ed.,Vol.37,No.1-2,37, 90-91 (1998),1998.01. M. Suenaga, Y. Miyahara, and T. Inazu,A Novel Approach to Extended Phenalenones,J. Org. Chem.,Vol.58,No.21,58, 5846-5848 (1993),1993.07. I. U. Khan, H. Takemura, M. Suenaga, T. Shinmozu, and T. Inazu,Azacalixarenes: New Macrocycles with Dimethyleneaza-Bridged Calix[4]arene Systems,J. Org. Chem.,Vol.58,No.11,58, 3158-3168 (1993),1993.07. K. Sako, T. Shinmyozu, H. Takemura, M. Suenaga, and T. Inazu,A Conformational Study of [3.3]Metacyclophanes Through Variable Temperature 1H NMR and Optical Rotation,J. Org. Chem.,Vol.57,No.24,57, 6536-6541 (1992),1992.09. T. Meno, K. Sako, M. Suenaga, M. Mouri, T. Shinmyozu, and T. Inazu,Conformational Analysis of [3.3.3](1,3,5)Cyclophane Systems,Can. J. Chem.,Vol.68,No.3,68, 440-445. (1990),1990.02. H. Takemura, M. Suenaga, K. Sakai, H. Kawachi, T. Shinmyozu, Y. Miyahara, and T. Inazu,Synthesis of (Aza)n[3n]Cyclophanes As Host Molecules,Journal of Inclusion Phenomena,2, 207-214 (1984),1984.03. K. Kurosawa, M. Suenaga, T. Inazu, and T. Yoshino,A Facile Synthesis of [3n]Cyclophanes, in which Aromatic Rings Are Connected With -CH2-CO-CH2- Bridges,Tetrahedron Letters,Vol.23,No.50,Tetrahedron Lett., 23, 5335-5338 (1982),1982.06.