Why Think Up New Molecules?
Adding to the world of known chemical structures is a wonderful mental experiment
Science is a marvelous quest for reliable knowledge. Knowing is a pleasure in and of itself. So is creation. As is sharing that knowledge, and yes, being thought of well for what one does.
The predictor leaves the safety of known molecules and properties for the unknown. He or she takes a risk. And, in a way, flirts—in a game of interest and synthesis—with the experimentalist. Predicting new molecules is simply great fun.
Schaefer, III, H. F. 1996. Odorless chemistry: A gentle reductionist companion to experiment.
Journal of the Chinese Chemical Society
Hoffmann, R., and H. Hopf. 2008. Learning from molecules in distress.
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Hoffmann, R. 2003. Why buy that theory?