6.09 – Chemoinformatics
作者： M.L. Peach , A.V. Zakharov , L. Guasch , M.C. Nicklaus
DOI: 10.1016/B978-0-444-53632-7.01111-4
关键词:
摘要: This is an overview of chemoinformatics, the branch chemical informatics that deals with small molecules and information about, associated with, them. chapter presents basic techniques major application areas chemoinformatics a section placing special emphasis on topics interest in context medical physics such as integration bioinformatics imaging agents, metal-organic compounds containing radionuclides.
sci-hub.se 参考文章(243)
Teuvo Kohonen, Self-organized formation of topologically correct feature maps Biological Cybernetics. ,vol. 43, pp. 509- 521 ,(1988) , 10.1007/BF00337288
Curt M Breneman, N Sukumar, Michael Krein, Bioinformatics and cheminformatics: where do the twain meet? Current Opinion in Drug Discovery & Development. ,vol. 11, pp. 311- 319 ,(2008)
Michael R. Goldsmith, Shane D. Peterson, Daniel T. Chang, Thomas R. Transue, Rogelio Tornero-Velez, Yu-Mei Tan, Curtis C. Dary, Informing Mechanistic Toxicology with Computational Molecular Models Methods in Molecular Biology. ,vol. 929, pp. 139- 165 ,(2012) , 10.1007/978-1-62703-050-2_7
Huma Lodhi, Yoshihiro Yamanishi, Chemoinformatics and Advanced Machine Learning Perspectives: Complex Computational Methods and Collaborative Techniques ,(2010)
Hajime IWAMURA, Toshio FUJITA, QSAR Studies in Pesticide Research in Japan Journal of Pesticide Science. ,vol. 7, pp. 289- 299 ,(1982) , 10.1584/JPESTICS.7.289
Chemoinformatics approaches to virtual screening : RSC Pub.,. ,(2008) , 10.1039/9781847558879
Chemoinformatics and computational chemical biology Humana Press. ,(2011) , 10.1007/978-1-60761-839-3
Johann Gasteiger, Thomas Engel, Chemoinformatics: A Textbook ,(2003)
D. Coomans, D.L. Massart, Alternative k-nearest neighbour rules in supervised pattern recognition : Part 1. k-Nearest neighbour classification by using alternative voting rules Analytica Chimica Acta. ,vol. 136, pp. 15- 27 ,(1982) , 10.1016/S0003-2670(01)95359-0
E. Zerhouni, Medicine. The NIH Roadmap. Science. ,vol. 302, pp. 63- 72 ,(2003) , 10.1126/SCIENCE.1091867