Literatur und Zusatzinformation

Spezielle Literatur

Statistische Methoden

• M. Otto, Chemometrics. Wiley-VCH, Weinheim, 1999
• D.L. Massart, B. G. M. Vandeginste, L. M. C.Buydens, S. De Jong, Handbook of Chemometrics and Qualimetrics: Two-Volume Set, Elsevier, 1998

Neuronale Netze und maschinelles Lernen

• M. Smith, Neural Networks in Statistical Modelling, Van Nostrand Reinhold, New York, 1993
• T. M. Mitchell, Machine Learning, McGrow-Hill, New York, 1997
• J. Zupan, J. Gasteiger, Neural Networks in Chemistry and Drug Design, Wiley-VCH, Weinheim, 1999
• N. Christiani, J. Shawe-Taylor, Support Vector Machines, Cambridge University Press, Cambridge, UK, 2000

Digitale Signalverarbeitung in der Chemie

• L. Eriksson, J. Trygg, E. Johansson, R. Bro, S. Wold, S. Orthogonal signal correction, wavelet analysis, and multivariate calibration of complicated process fluorescence data, Anal. Chim. Acta, 2000, 420, 181-195

Software und interessante Websites

• SPSS - Statistik-Software http://www.spssscience.com/sigmastat/index.cfm
• CAMO http://www.camo.no/p2_tuf.htm
• SIMCA von Umetrics - http://www.umetrics.com
• ELECTRAS - Web-basiertes Datenanalyse-System http://www2.chemie.uni-erlangen.de/projects/eDAS/index.html
• SONNIA, KSOM und CPG Neuronale Netze http://www2.chemie.uni-erlangen.de/
• Weka (Machine Learning Software in Java); Department of Computer Science, University of Waikato; http://www.cs.waikato.ac.nz/~ml/weka/index.html
• SNNS (Stuttgart Neural Network Simulator); Wilhelm-Schickard-Institut für Informatik, University of Tübingen; http://www-ra.informatik.uni-tuebingen.de/SNNS/
• GAlib (C++ Library of Genetic Algorithm Components), Massachusetts Institute of Technology; http://lancet.mit.edu/ga/

© Prof. Dr. J. Gasteiger, Dr. Th. Engel, CCC Univ. Erlangen, Mon Apr 19 13:45:23 2004 GMT
BMBF-Leitprojekt Vernetztes Studium - Chemie