Values and Practices of Cheminformatics in Chemical World
Keywords: cheminformatics, drug discovery, pharmaceutical company, value and practices of cheminformatics
K. Bhat, C. Bock, N.J. Howard. COS and HTS design of high-performance, nontoxic chemicals for textiles, NTC Project: C00-PH01. (formerly C00-P01).
F.K. Brown. Chemoinformatics: what is it and how does it impact? Drug Discov Ann Rep Med Chem. 1998; 33: 375–84p.
D.E. Clark, S.D. Pickett. Computational methods for the prediction of ‘drug likeness, Drug Discov Today. 2000; 5: 49–58p.
J. Drews. Drug discovery: a historical perspective, Science. 2000; 287 5463: 1960–4p.
J. Gasteiger, K. Funatsu. Chemoinformatics – an important scientific discipline, J Comput Chem Jpn. 2006; 5(2): 53–8p.
J. Gasteiger (ed.), Handbook of cheminformatics – From Data to Knowledge. Weinheim: Wiley-VCH; 2003.
J. Gasteiger, J.T. Engel (eds.), Chemoinformatics – A Textbook. Weinheim: Wiley-VCH; 2003.
J. Zupan, J. Gasteiger. Neural Networks in Chemistry and Drug Design. 2nd Edn., Weinheim: Wiley-VCH; 1999.
A.R. Leach, V.J. Gillet. An Introduction to Chemoinformatics. Springer; 2003,1–57p.
C.A. Lipinski, F. Lombardo, B.W. Dominy, P.J. Feeney. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development
settings, Adv Drug Deliv Rev. 1997; 23: 3–25p.
T.I. Oprea, A.M. Davis, S.J. Teague, P.D. Leeson. Is there a difference between leads and drugs? A historical perspective, J Chem Inf Comput Sci. 2001; 41: 1308–15p.
R.K. Lindsay, B.G. Buchanan, E.A. Feigenbaum, J. Lederberg. Applications of artificial intelligence for organic chemistry, The Dendral Project. New York: McGraw-Hill; 1980.
J.D. Wild. Getting started in chemoinformatics, Version 1.0, September 2004 Woo, Environ Carc Ecotox Rev. 1996; C14: 1–42p.
J. Xu, A. Hagler. Chemoinformatics and drug discovery, Molecules. 2002; 7: 566–600p.
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