Quadratic descriptors and reduction methods in a two-layered model for compound inference

Compound inference models are crucial for discovering novel drugs in bioinformatics and chemo-informatics. These models rely heavily on useful descriptors of chemical compounds that effectively capture important information about the underlying compounds for constructing accurate prediction function...

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Bibliographic Details
Main Authors: Jianshen Zhu, Naveed Ahmed Azam, Shengjuan Cao, Ryota Ido, Kazuya Haraguchi, Liang Zhao, Hiroshi Nagamochi, Tatsuya Akutsu
Format: Article
Language:English
Published: Frontiers Media S.A. 2025-01-01
Series:Frontiers in Genetics
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Online Access:https://www.frontiersin.org/articles/10.3389/fgene.2024.1483490/full
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