Yoshiyuki Koyano

According to our database, Yoshiyuki Koyano authored at least 4 papers between 2010 and 2011.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2011

Toward a new approach for determination of solute's charge distribution to analyze interatomic electrostatic interactions in quantum mechanical/molecular mechanical simulations.

Kenta Yamada, Yoshiyuki Koyano, Takuya Okamoto, Toshio Asada, Nobuaki Koga, Masataka Nagaoka

J. Comput. Chem., 2011

A minimal implementation of the AMBER-GAUSSIAN interface for <i>ab initio</i> QM/MM-MD simulation.

Takuya Okamoto, Kenta Yamada, Yoshiyuki Koyano, Toshio Asada, Nobuaki Koga, Masataka Nagaoka

J. Comput. Chem., 2011

2010

An optimum strategy for solution chemistry using semiempirical molecular orbital method: Importance of description of charge distribution.

Norio Takenaka, Yoshiyuki Koyano, Yukinori Nakagawa, Masataka Nagaoka

J. Comput. Chem., 2010

An optimum strategy for solution chemistry using semiempirical molecular orbital method. II. Primary importance of reproducing electrostatic interaction in the QM/MM framework.

Yoshiyuki Koyano, Norio Takenaka, Yukinori Nakagawa, Masataka Nagaoka

J. Comput. Chem., 2010