Journal Paper

• Masatake Sugita, Takuya Fujie, Keisuke Yanagisawa, Masahito Ohue, Yutaka Akiyama. Lipid Composition Is Critical for Accurate Membrane Permeability Prediction of Cyclic Peptides by Molecular Dynamics Simulations, Journal of Chemical Information and Modeling, American Chemical Society, Volume 62, Issue 18, pp. 4549-4560, Sept. 2022.  Official location  

Other Publication

• Yudai Noso, Masatake Sugita, Takuya Fujie, Keisuke Yanagisawa, Masahito Ohue, Hirokuni AKIYAMA. 分子動力学シミュレーション軌跡データからの環状ペプチドの膜透過性と相関が高い特徴量の抽出, 研究報告バイオ情報学（BIO）, 情報処理学会, 2022-BIO-70, 50, 1-8, June 2022.  Official location  

Patent

• Yutaka Akiyama, Masahito Ohue, Keisuke Yanagisawa, Yasushi Yoshikawa, Masatake Sugita, Satoshi Sugiyama, Shotaro Murata. 予測装置、学習済みモデルの生成装置、予測方法、学習済みモデルの生成方法、予測プログラム、及び学習済みモデルの生成プログラム. Patent. Registered. 国立大学法人東京工業大学. 2021/02/26. 特願2021-031234. 特許第7057003号. 2022/04/11 2022.

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