Masataka Nagaoka

Publication Activity (10 Years)

Years Active: 2010-2019
Publications (10 Years): 2

Top Topics

Simulation Study

Protein Folding

Decision Support

Molecular Dynamics

Top Venues

J. Comput. Chem.

Publications

Kentaro Matsumoto, Masayoshi Takayanagi, Yuichi Suzuki, Nobuaki Koga, Masataka Nagaoka
Atomistic chemical computation of Olefin polymerization reaction catalyzed by (pyridylamido)hafnium(IV) complex: Application of Red Moon simulation. J. Comput. Chem. 40 (2) (2019)
Taichi Inagaki, Masataka Nagaoka
Electrode polarization effects on interfacial kinetics of ionic liquid at graphite surface: An extended lagrangian-based constant potential molecular dynamics simulation study. J. Comput. Chem. 40 (24) (2019)
Takuya Okamoto, Kenta Yamada, Yoshiyuki Koyano, Toshio Asada, Nobuaki Koga, Masataka Nagaoka
QM/MM-MD simulation. J. Comput. Chem. 32 (5) (2011)
Kenta Yamada, Yoshiyuki Koyano, Takuya Okamoto, Toshio Asada, Nobuaki Koga, Masataka Nagaoka
Toward a new approach for determination of solute's charge distribution to analyze interatomic electrostatic interactions in quantum mechanical/molecular mechanical simulations. J. Comput. Chem. 32 (14) (2011)
Yoshiyuki Koyano, Norio Takenaka, Yukinori Nakagawa, Masataka Nagaoka
An optimum strategy for solution chemistry using semiempirical molecular orbital method. II. Primary importance of reproducing electrostatic interaction in the QM/MM framework. J. Comput. Chem. 31 (14) (2010)
Norio Takenaka, Yoshiyuki Koyano, Yukinori Nakagawa, Masataka Nagaoka
An optimum strategy for solution chemistry using semiempirical molecular orbital method: Importance of description of charge distribution. J. Comput. Chem. 31 (6) (2010)