Patent ID: 6600970
Filing Date: 2003-07-29
Classification: G16C,Y10S

Abstract:
A method of establishing one or more synthesis paths by a computer comprising:a) constructing a first database of educts and products, b) allocating a unique code to each of the educts and products and storing the codes with allocations in the first or a further database, c) constructing a second database of reactions in which the stored educts and/or products occur, d) selecting one or more educts or products, e) searching through the second database for reactions in which the one or more selected educts and/or products occur, and effecting intermediate storage of said reactions, f) searching through the second database for reactions in which the educts and/or products of the reactions occur, which were found and put into intermediate storage in step e), and effecting intermediate storage of the reactions obtained, and g) preparing at least one reaction chain and/or reaction tree of the obtained reactions that contain the one or more selected educts or products.