Computational techniques to automatically generate large sets of structures are becoming increasingly widespread, especially in the field of drug design. Methods of automatically prioritising these structures are central to the effective application of structure generation programs to solve practical problems. CAESA is a computer program to automatically rank sets of molecules according to their ease of synthesis.
Ranking sets of molecules according to their ease of synthesis
Assisting the development of viable synthetic approaches by identifying suitable, readily available starting materials.
More information on CAESA is available under the following topics
Please address any comments/suggestions/questions to Prof. A.P. Johnson
