Chemoinformatics and advanced machin...
Lodhi, Huma M.

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  • Chemoinformatics and advanced machine learning perspectives = complex computational methods and collaborative techniques /
  • 紀錄類型: 書目-電子資源 : Monograph/item
    正題名/作者: Chemoinformatics and advanced machine learning perspectives/ Huma Lodhi and Yoshihiro Yamanashi, editors.
    其他題名: complex computational methods and collaborative techniques /
    其他作者: Lodhi, Huma M.
    出版者: Hershey, Pa. :IGI Global (701 E. Chocolate Avenue, Hershey, Pennsylvania, 17033, USA), : c2011.,
    面頁冊數: electronic texts (xvii, 400 p. : ill.) :digital files.
    內容註: 1. Graph kernels for chemoinformatics / Hisashi Kashima, Hiroto Saigo, Masahiro Hattori, Koji Tsuda -- 2. Optimal assignment kernels for ADME in silico prediction / Holger Fr{uml}ohlich -- 3. 3D ligand-based virtual screening with support vector machines / Jean-Philippe Vert -- 4. A simulation study of the use of similarity fusion for virtual screening / Martin Whittle, Valerie Gillet, Peter Willett -- 5. Structure-activity relationships by autocorrelation descriptors and genetic algorithms / Viviana Consonni, Roberto Todeschini -- 6. Graph mining in chemoinformatics / Hiroto Saigo, Koji Tsuda -- 7. Protein homology analysis for function prediction with parallel sub-graph isomorphism / Alper K{uml}u{cedil}c{uml}ukural, Andras Szilagyi, O. Sezerman, Yang Zhang -- 8. Advanced PLS techniques in chemometrics and their applications to molecular design / Kiyoshi Hasegawa, Kimito Funatsu -- 9. Nonlinear partial least squares : an overview / Roman Rosipal -- 10. Virtual screening methods based on Bayesian statistics / Martin Vogt, J{uml}urgen Bajorath -- 11. Learning binding affinity from augmented high throughput screening data / Nicos Angelopoulos, Andreas Hadjiprocopis, Malcolm Walkinshaw -- 12. Application of machine leaning in drug discovery and development / Shuxing Zhang -- 13. Learning and prediction of complex molecular structure-property relationships / Rahul Singh -- 14. Learning methodologies for detection and classification of mutagens / Huma Lodhi -- 15. Brain-like processing and classification of chemical data / Michael Schmuker, Gisbert Schneider -- 16. Prediction of compound-protein interactions with machine learning methods / Yoshihiro Yamanishi, Hisashi Kashima -- 17. Chemoinformatics on metabolic pathways / Masahiro Hattori, Masaaki Kotera.
    標題: Cheminformatics. -
    電子資源: http://services.igi-global.com/resolvedoi/resolve.aspx?doi=10.4018/978-1-61520-911-8
    ISBN: 9781615209125 (ebk.)
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W9274438 電子資源 11.線上閱覽_V 電子書 EB QD39.3.E46 C45 2011e 一般使用(Normal) 在架 0
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