Calculation of Intermediate nodes of a Reaction Route Graph
The program takes the intermediate stoichiometric matrix of a chemical reaction mechanism as the input and gives the intermediate nodes in terms of all the possible combinations of p-(q-1) reaction steps. This program is complimentary to the "Reaction Routes" program. Using both these programs a Reaction Route Graph for a chemical reaction mechanism can be constructed, which can be used for kinetics studies.
Cite As
Vijay Periasamy (2024). Calculation of Intermediate nodes of a Reaction Route Graph (https://www.mathworks.com/matlabcentral/fileexchange/27854-calculation-of-intermediate-nodes-of-a-reaction-route-graph), MATLAB Central File Exchange. Retrieved .
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1.0.0.0 |