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Clustering of 3D-Structure Similarity Based Network of Secondary Metabolites Reveals Their Relationships with Biological Activities.

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第一作者： Yuki,Ohtana

第一单位： Graduate School of Information Science, Nara Institute of Science and Technology, 8916-5 Takayama, Ikoma, Nara 630-0192, Japan.

作者： Yuki,Ohtana ^[1] ; Azian Azamimi,Abdullah ^[1] ; Md,Altaf-Ul-Amin ^[1] ; Ming,Huang ^[1] ; Naoaki,Ono ^[1] ; Tetsuo,Sato ^[1] ; Tadao,Sugiura ^[1] ; Hisayuki,Horai ^[2] ; Yukiko,Nakamura ^[1] ; Aki,Morita Hirai ^[1] ; Klaus W,Lange ^[3] ; Nelson K,Kibinge ^[1] ; Tetsuo,Katsuragi ^[1] ; Tsuyoshi,Shirai ^[4] ; Shigehiko,Kanaya ^[5]

作者单位： Graduate School of Information Science, Nara Institute of Science and Technology, 8916-5 Takayama, Ikoma, Nara 630-0192, Japan. ^[1] Electronic and Computer Engineering, Ibaraki National College of Technology, 866 Nakane, Hitachinaka, Ibaraki 312-8508, Japan. ^[2] Department of Experimental Psychology, University of Regensburg, 93040 Regensburg, Germany. ^[3] Nagahama Institute of Bio-Science and Technology, Nagahama, Shiga, 526-0829, Japan. t_shirai@nagahama-i-bio.ac.jp. ^[4] Graduate School of Information Science, Nara Institute of Science and Technology, 8916-5 Takayama, Ikoma, Nara 630-0192, Japan. skanaya@gtc.naist.jp. ^[5]

关键词 Biological activities Clustering of 3D-structure similarity KNApSAcK family databases Metabolites Network of secondary metabolites Phytochemistry Structure?property relationships Visualization, Cheminformatics ′Bioinformatics

DOI 10.1002/minf.201400123

PMID 27485425

发布时间 2016-08-03

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