SpecTool: a hypermedia toolkit for structure elucidation. - Marc Cadisch; Margit Farkas; Jean Thomas Clerc; Ernö Pretsch (J. Chem. Inf. Comput. Sci., 1992)

C13Shift: a computer program for the prediction of carbon-13 NMR spectra based on an open set of additivity rules. - Ernö Pretsch; Andras Furst; Martin Badertscher; Renate Buergin; Morton E. Munk (J. Chem. Inf. Comput. Sci., 1992)

MacSpec and ConvertIt. - Tilman Brodmeier; Ernö Pretsch (J. Chem. Inf. Comput. Sci., 1993)

Application of Genetic Algorithms in Molecular Modeling. - Tilman Brodmeier; Ernö Pretsch (J. Comput. Chem., 1994)

Spectra Estimation for Computer-Aided Structure Determination. - Renate Bürgin Schaller; Morton E. Munk; Ernö Pretsch (J. Chem. Inf. Comput. Sci., 1996)

General Characteristics of Good-List and Bad-List Entries for Structure Generators from Spectra. - Hans Schriber; Ernö Pretsch (J. Chem. Inf. Comput. Sci., 1997)

Rule-Based System To Derive Automatically Good-List and Bad-List Entries for Structure Generators from Spectra. - Hans Schriber; Ernö Pretsch (J. Chem. Inf. Comput. Sci., 1997)

Quality Criteria of Genetic Algorithms for Structure Optimization. - Ron Wehrens; Ernö Pretsch; Lutgarde M. C. Buydens (J. Chem. Inf. Comput. Sci., 1998)

Automated Compatibility Tests of the Molecular Formulas or Structures of Organic Compounds with Their Mass Spectra. - Bernhard Seebass; Ernö Pretsch (J. Chem. Inf. Comput. Sci., 1999)

A Novel Formalism To Characterize the Degree of Unsaturation of Organic Molecules. - Martin Badertscher; Kaspar Bischofberger; Morton E. Munk; Ernö Pretsch (J. Chem. Inf. Comput. Sci., 2001)

Automatic Spectra Interpretation, Structure Generation, and Ranking. - Patrick Fontana; Ernö Pretsch (J. Chem. Inf. Comput. Sci., 2002)