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Systematichem
Computational organic chemistry software for retrosynthesis and synthesis development.
Afferent
Tools for tracking the information associated with combinatorial libraries and parallel medicinal chemistry syntheses.
LHASA Group at Harvard University
LHASA (Logic and Heuristics Applied to Synthetic Analysis) is among the first programs for retrosynthetic analysis. Also on this page, the DEREK system for toxicology prediction. Available for Silicon Graphics/Irix, and Linux.
CAChe Group
Provides software to view and predict 3D molecular structure and properties and to analyze the relationship between structure and properties or structure and reactivity. CAChe is a tool for medicinal, polymer, process and synthetic chemists.
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