Monthly Archives: September 2018

A review paper on RAQET, a practical relativistic quantum chemistry calculation program developed in CREST research was published in J. Comput. Chem.

Posted on

CREST研究で開発した実用的相対論的量子化学計算プログラムRAQETの解説論文がJ. Comput. Chem.に掲載されました。

“RAQET: Large‐Scale Two‐Component Relativistic Quantum Chemistry Program Package”
Masao Hayami Junji Seino Yuya Nakajima Masahiko Nakano Yasuhiro Ikabata Takeshi YoshA review paper on RAQET, a practical relativistic quantum chemistry calculation program developed in CREST research was published in J. Comput. Chem.

The 56th Annual meeting of the biophysical society of Japan was held in Okayama

Posted on

The 56th Annual meeting of the biophysical society of Japan　was held in Okayama

Date：2018/9/15(Sat)～17日(Mon)
Place：Okayama University, Tsushima Campus
Sponsor： The biophysical society of Japan

Poster session

  • Junichi Ono, Minori Imai, Yoshifumi Nishimura, Hiromi Nakai, “Large-scale quantum-mechanical molecular dynamics simulations for the primary proton transfer in bacteriorhodopsin”, 2Pos103, 2018/9/16 16:30-17:30.
  • Nana Komoto, Takeshi Yoshikawa, Junichi Ono, Hiromi Nakai, “Development of large-scale excited-state calculation method and applied research on photoactive yellow protein”, 2Pos104, 2018/9/16 17:30-18:30.