1. Foreword

   • Kurt Varmuza
   • Wolfhard Wegscheider

   EditorialNotes Pages: 1 - 1

2. Introduction to COBAC IV

   • Hanns Malissa

   OriginalPaper Pages: 3 - 13

3. Laboratory robotics — Past, present, and future

   • Grover D. Owens
   • Rodney J. Eckstein
   • Thomas P. Franz

   OriginalPaper Pages: 15 - 30

4. Monitoring accuracy and precision — Improvements by introducing robust and resistant statistics

   • Clemens Reimann
   • Friedrich Wurzer

   OriginalPaper Pages: 31 - 42

5. Use of indirect multivariate calibration for quality control of agricultural products by near infrared spectroscopy

   • Gerd Puchwein
   • Anton Eibelhuber

   OriginalPaper Pages: 43 - 51

6. Simulation techniques in analytical chemistry. Microcomputer-controlled simulation of the chromatographie process with an analogue computer

   • Werner Lenhart
   • Peter Zinn

   OriginalPaper Pages: 53 - 61

7. The multivariate N-Component resolution problem with minimum assumptions

   • Odd S. Borgen
   • Nina Davidsen
   • Øyvind Øyen

   OriginalPaper Pages: 63 - 73

8. Computer-aided library search of combined LC-Retention and diode-array-UV-spectral data

   • Hendrik -Jan Boessenkool
   • Peter Cleij
   • Henk A. van't Klooster

   OriginalPaper Pages: 75 - 92

9. Fuzzy theory in analytical chemistry

   • Hans Bandemer
   • Matthias Otto

   OriginalPaper Pages: 93 - 124

10. Partial least-squares regression and fuzzy clustering — A joint approach

    • Tove Jacobsen
    • Knut Kolset
    • Nils B. Vogt

    OriginalPaper Pages: 125 - 138

11. UNEQ: A class modelling supervised pattern recognition technique

    • M. P. Derde
    • D. L. Massart

    OriginalPaper Pages: 139 - 152

12. Multi-inductive component analysis — A powerful tool in pattern recognition

    • H. Steigstra
    • G. Kateman
    • A. P. Jansen

    OriginalPaper Pages: 153 - 161

13. Knowledge-based systems for analytical chemistry

    • Jack W. Frazer

    OriginalPaper Pages: 163 - 185

14. Computer-aided fault diagnosis in technical systems: An expert system for fault identification in the vacuum system of a mass spectrometer

    • W. Staringer
    • H. Groiss
    • K. Varmuza

    OriginalPaper Pages: 187 - 198

15. Computer-assisted chemical structure analysis

    • Morton E. Munk
    • Margit Farkas
    • Bradley D. Christie

    OriginalPaper Pages: 199 - 215

16. Performance analysis of infrared library search systems

    • J. T. Clerc
    • E. Pretsch
    • M. Zürcher

    OriginalPaper Pages: 217 - 242

17. Handling large amounts of chemical data

    • Jure Zupan

    OriginalPaper Pages: 243 - 260

18. Distributed data processing in NMR spectroscopy

    • H. Armitage
    • P. C. Gentz
    • D. Ziessow

    OriginalPaper Pages: 261 - 270

19. Computer-assisted structure elucidation of organic compounds III: Automatic fragment generation from¹³C-NMR spectra

    • Wolfgang Robien

    OriginalPaper Pages: 271 - 279

20. Use of¹³C chemical shift/charge density linear relationship for ranking chemical structures

    • Ivan P. Bangov

    OriginalPaper Pages: 281 - 289

21. Effects of sampling methodologies on FT-IR data base searching

    • R. J. Rosenthal
    • S. R. Lowry

    OriginalPaper Pages: 291 - 302

22. Use of a symbolic algebra program in NMR

    • A. Khuen

    OriginalPaper Pages: 303 - 312

23. Application of pattern recognition methods in secondary ion mass spectrometry

    • Peter Wilhartitz
    • Manfred Grasserbauer

    OriginalPaper Pages: 313 - 324

24. Photoplate data acquisition in mass spectrometry with the IBM-PC/AT

    • L. Radermacher

    OriginalPaper Pages: 325 - 333

25. A software package for the evaluation of Zeeman AAS data using a Perkin-Elmer model 3600 data station

    • G. Bozsai
    • Z. Karpati
    • Z. Balogh

    OriginalPaper Pages: 335 - 356

26. Background correction by wavelength modulation using a microcomputer in atomic emission spectrometry

    • Ali Gökmen
    • Mehrdad Delzendeh
    • John M. Ottaway

    OriginalPaper Pages: 357 - 367

27. Use of chemometrics in industrial process diagnostics

    • D. E. Leyden
    • J. B. Atwater

    OriginalPaper Pages: 369 - 377

28. Critical comparison of evaluation methods of potentiometric titration data using a microcomputer-controlled automatic potentiometric titration system

    • J. Házi
    • L. Daruházi
    • Zs. Szakály

    OriginalPaper Pages: 379 - 388

29. Approximation of titration curves and other sigmoidal functions by proportionally spaced cubic B-splines

    • Otto Glatter
    • Herbert Greschonig

    OriginalPaper Pages: 389 - 399

30. Determination of equivalence points of sigmoidal potentiometric titration curves

    • Herbert Greschonig
    • Otto Glatter

    OriginalPaper Pages: 401 - 409

31. Computer generation of chemical structures from known fragments

    • Marko Razinger
    • Jure Zupan
    • Marjana Novič

    OriginalPaper Pages: 411 - 421

32. Data in Beilstein-Online

    • L. Domokos
    • C. Jochum
    • G. Wittig

    OriginalPaper Pages: 423 - 429