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Please use this identifier to cite or link to this item: http://hdl.handle.net/10119/10332

Title: Simulation-based Data Mining Solution to the Structure of Water Surrounding Proteins
Authors: Dam, Hieu Chi
Ho, Tu Bao
Sugiyama, Ayumu
Keywords: water structure
hydation water
data mining
Issue Date: 2011
Publisher: International Joint Conferences on Artificial Intelligence
Magazine name: Proceedings of the Twenty-Second International Join Conference on Artificial Intelligence (IJCAI-2011)
Start page: 2424
End page: 2429
DOI: 10.5591/978-1-57735-516-8/IJCAI11-404
Abstract: What is structure of water surrounding proteins remains as one of fundamental unsolved problems of science. Methods in biophysics only provide qualitative description of the structure and thus clarifying the collective phenomena of a huge number of water molecules is still beyond intuition in biophysics. We introduce a simulation-based data mining approach that quantitatively model the structure of water surrounding a protein as clusters of water molecules having similar moving behavior. The paper presents and explains how the advances of AI technique can potentially solve this challenging data-intensive problem.
Rights: Copyright (C) 2011 International Joint Conferences on Artificial Intelligence. Hieu Chi Dam, Tu Bao Ho, Ayumu Sugiyama, Proceedings of the Twenty-Second International Join Conference on Artificial Intelligence (IJCAI-2011), 2011, 2424-2429. http://dx.doi.org/10.5591/978-1-57735-516-8/IJCAI11-404
URI: http://hdl.handle.net/10119/10332
Material Type: publisher
Appears in Collections:a11-1. 会議発表論文 (Conference Papers)

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