Journal of Computer Aided Chemistry

Journal of Computer Aided Chemistry

Published by Division of Chemoinformatics and Computer Sciences The Chemical Society of Japan

194 registered articles
(updated on February 16, 2026)

Online ISSN : 1345-8647
ISSN-L : 1345-8647

JOURNAL PEER REVIEWED FREE ACCESS

Formation of machine learning models of high-refractive index organic materials through high-throughput quantum chemical calculations Hajime Mori, Asami Yoshii, Munenori Yamashita

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Most viewed articles (January 2026)

1

Theoretical Study on Reaction Mechanism of Curing Reaction of Epoxy-Imidazole Resin

Released on J-STAGE: February 17, 2024 | Volume 23 Pages 35-42

Ryusuke Mitani, Hidetoshi Yamamoto, Michinori Sumimoto
2

Electron Transfer at Dye-sensitized Solar Cells. 2.

Released on J-STAGE: February 02, 2002 | Volume 3 Pages 15-36

Tetsuji Ogawa, Yoshihiro Ishikawa, Osamu Kitao, Shigenori Tanaka, Ching-ju Wen, Junichiro Otomo, Hiroshi Takahashi, Hironori Arakawa
3

Structure Properties Relationship of Ionic Liquid

Released on J-STAGE: March 24, 2006 | Volume 7 Pages 18-30

Hiroshi Yamamoto
4

Critical Assessment of Generative Models for de Novo Molecular Structure Generation

Released on J-STAGE: February 17, 2024 | Volume 23 Pages 1-7

Tomoyuki Miyao
4

Signal Detection of Drug Complications Applying Association Rule Learning for Stevens-Johnson Syndrome

Released on J-STAGE: November 19, 2009 | Volume 10 Pages 118-127

Yuko Shirakuni, Kousuke Okamoto, Norihito Kawashita, Teruo Yasunaga, Tatsuya Takagi

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