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Comparative evaluation of atom mapping algorithms for balanced metabolic reactions: application to Recon 3D

The mechanism of each chemical reaction in a metabolic network can be represented as a set of atom mappings, each of which relates an atom in a substrate metabolite to an atom of the same element in a product metabolite. Genome-scale metabolic network reconstructions typically represent biochemistry...

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Dettagli Bibliografici
Pubblicato in:J Cheminform
Autori principali: Preciat Gonzalez, German A., El Assal, Lemmer R. P., Noronha, Alberto, Thiele, Ines, Haraldsdóttir, Hulda S., Fleming, Ronan M. T.
Natura: Artigo
Lingua:Inglês
Pubblicazione: Springer International Publishing 2017
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC5471289/
https://ncbi.nlm.nih.gov/pubmed/29086112
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-017-0223-1
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