The REACT Program
Rapid Enumeration by Automated Combinatorial Tool
REACT is a tool for in silico combinatorial chemistry.
This program creates library of molecules by combining fragment libraries based on a user-defined chemical reaction. It can also perform an enumeration from generic attachment points on the fragments. The program will automatically identify compatible chemicals within a catalogue database and combine them according to the defined chemistry or transformation.
More details about the REACT program can be found in the references.