The 101st CSJ Annual Meeting

Presentation information

Academic Program [Oral A]

02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry » Oral A

[A26-3pm] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Sun. Mar 21, 2021 1:00 PM - 2:30 PM Room 26 (Online Meeting)

Chair:Hirofumi Sato, Manabu Sugimoto

2:10 PM - 2:20 PM

[A26-3pm-08] Learning Catalyst Design Based on Bias-free Dataset for Oxidative Coupling of Methane

Sunao Nakanowatari1, Thanh Nhat Nguyen1, Toshiaki Taniike1 (1. Japan Advanced Institute of Science and Technology)

[Lang.] Japanese

Keywords:Catalyst Informatics, High-throughput screening, Oxidative coupling of methane, Bias-free Dataset, Machine Learning