[H937-3am] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

9:00 AM - 9:20 AM JST(12:00 AM - 12:20 AM UTC)Japanese

[H937-3am-01] Geometric Classification of Organic Chemical Reactions by Self-organizing maps and Transition State Motifs

○Yujiro Matsuo¹, Toru Yamaguchi¹, Kimito Funatsu², Kenji Hori^1,3,4 (1. Transition State Technology Company Limited, 2. Nara Institute of Science and Technology, 3. National Institute of Advanced Industrial Science and Technology, 4. Yamaguchi University)

Keywords:

Transition State Database(TSDB),Transition state motifs,Kohonen's self-organizing map