Computer Assisted Bilateral Generation of Reaction Networks from Educts and Products

  • Fontain E
  • Bauer J
  • Ugi I
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Abstract

A computer program (FORTRAN 77 for IBM-PC) for generating reaction pathways between given educts and products of chemical reactions and their sequences is presented. This program is based on the theory of the BE- and R-matrices. Some applications to known chemical reactions are described as examples.

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Fontain, E., Bauer, J., & Ugi, I. (1987). Computer Assisted Bilateral Generation of Reaction Networks from Educts and Products. Chemistry Letters, 16(1), 37–40. https://doi.org/10.1246/cl.1987.37

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