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dGPredictor: Automated fragmentation method for metabolic reaction free energy prediction and de novo pathway design
Group contribution (GC) methods are conventionally used in thermodynamics analysis of metabolic pathways to estimate the standard Gibbs energy change (Δ(r)G′(o)) of enzymatic reactions from limited experimental measurements. However, these methods are limited by their dependence on manually curated...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Public Library of Science
2021
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8496854/ https://www.ncbi.nlm.nih.gov/pubmed/34570771 http://dx.doi.org/10.1371/journal.pcbi.1009448 |