Abstract
New algorithms for the detection of chemically significant similarity between organic molecules are presented. The application of these algorithms to the determination of starting materials for the synthesis of organic targets is demonstrated in a program system called WODCA.
Access this chapter
Tax calculation will be finalised at checkout
Purchases are for personal use only
Preview
Unable to display preview. Download preview PDF.
Similar content being viewed by others
References
Ihlenfeldt WD, Gasteiger J (1988) In: Software-Entwicklung in der Chemie 2, Gasteiger J (ed). Springer, Berlin Heidelberg New York, p. 13–33
Gasteiger J, Marsili M (1980) Tetrahedron 36:3219
Gasteiger J, Ihlenfeldt WD (1990) In: Warr W (ed) Proceedings of the Chemical Structures Conference 1990, in press
Gasteiger J, Hutchings MG, Christoph B, Gann L, Hiller C, Löw P, Marsili M, Sailer H, Yuki K (1987) Topics Curr. Chem. 137:19
Gasteiger J, Ihlenfeldt WD (1990) In: Software-Development in Chemistry 4, Gasteiger J (ed). Springer, Berlin Heidelberg New York, p. 57–65
Author information
Authors and Affiliations
Editor information
Editors and Affiliations
Rights and permissions
Copyright information
© 1991 Springer-Verlag Berlin Heidelberg
About this paper
Cite this paper
Ihlenfeldt, W.D., Gasteiger, J. (1991). Synthesis Planning based upon the Similarity of Chemical Structures. In: Gmehling, J. (eds) Software Development in Chemistry 5. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-642-76325-0_7
Download citation
DOI: https://doi.org/10.1007/978-3-642-76325-0_7
Publisher Name: Springer, Berlin, Heidelberg
Print ISBN: 978-3-540-53532-4
Online ISBN: 978-3-642-76325-0
eBook Packages: Springer Book Archive