Abstract
Chemical synthesis is one of the most important tasks both of pure as well as of applied organic chemistry. Since the middle of the 1960s, attempts have been made to explore the initial stages of organic synthesis design (e.g. searching for the most effective synthetic steps to prepare the target compound from the available substrate and reagents) using computers. This so-called computer-assisted organic synthesis formed a new branch of theoretical (or rather computational) chemistry. There are three basic approaches of interest in this field: (i) Synthesis in the forward direction, (ii) retrosynthesis, and (iii) reaction mechanisms of particular reactions. The third of these items has already been discussed in Chap. 4.
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Koča, J., Kratochvíl, M., Matyska, L., Kvasnička, V., Pospíchal, J. (1989). The Synthon Model and Organic Synthesis. In: Synthon Model of Organic Chemistry and Synthesis Design. Lecture Notes in Chemistry, vol 51. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-642-93416-2_6
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DOI: https://doi.org/10.1007/978-3-642-93416-2_6
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