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Quantum Chemical Approach to Estimating the Thermodynamics of Metabolic Reactions

Thermodynamics plays an increasingly important role in modeling and engineering metabolism. We present the first nonempirical computational method for estimating standard Gibbs reaction energies of metabolic reactions based on quantum chemistry, which can help fill in the gaps in the existing thermo...

Deskribapen osoa

Gorde:
Xehetasun bibliografikoak
Argitaratua izan da:Sci Rep
Egile Nagusiak: Jinich, Adrian, Rappoport, Dmitrij, Dunn, Ian, Sanchez-Lengeling, Benjamin, Olivares-Amaya, Roberto, Noor, Elad, Even, Arren Bar, Aspuru-Guzik, Alán
Formatua: Artigo
Hizkuntza:Inglês
Argitaratua: Nature Publishing Group 2014
Gaiak:
Sarrera elektronikoa:https://ncbi.nlm.nih.gov/pmc/articles/PMC5381496/
https://ncbi.nlm.nih.gov/pubmed/25387603
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep07022
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