Stochastic Generator of Chemical Structure. 3. Reaction Network Generation

Journal of Chemical Information and Computer Sciences

Volumn 41, Issue 4, 2001, Pages 894-908

  Faulon, Jean Loup ^a   Sault, Allen G ^a  

^a SANDIA NATIONAL LABORATORIES   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMBUSTION; CRACKING (CHEMICAL); CRUDE PETROLEUM; HYDROCARBONS; POLYNOMIALS; RANDOM PROCESSES; SAMPLING;

REACTION NETWORK GENERATION;

STRUCTURE (COMPOSITION);

EID: 0035412791     PISSN: 00952338     EISSN: None     Source Type: Journal    
DOI: 10.1021/ci000029m     Document Type: Article

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26. max, maximum reaction order; r, maximum number of atoms per elementary transition; R, maximum number of elementary transitions.