Publications
Research Areas :
Nature Communications, 2022
Chemoinformatics / Materials Science
By : So Takamoto, Chikashi Shinagawa, Daisuke Motoki, Kosuke Nakago, Wenwen Li, Iori Kurata, Taku Watanabe, Yoshihiro Yayama, Hiroki Iriguchi, Yusuke Asano, Tasuku Onodera, Takafumi Ishii, Takao Kudo, Hideki Ono, Ryohto Sawada, Ryuichiro Ishitani, Marc Ong, Taiki Yamaguchi, Toshiki Kataoka, Akihide Hayashi, Nontawat Charoenphakdee, Takeshi Ibuka
Population-based De Novo Molecule Generation, Using Grammatical Evolution
Chemistry Letters, 47, 1431-1434, 2018
Chemoinformatics / Materials Science
By : Naruki Yoshikawa, Kei Terayama, Masato Sumita, Teruki Homma, Kenta Oono, Koji Tsuda
Semi-supervised learning of hierarchical representations of molecules with neural message passing
Machine Learning for Molecules and Materials in NIPS 2017
Chemoinformatics / Materials Science
By : Hai Nguyen, Shin-ichi Maeda, Kenta Oono