Beber, Moritz Emanuel
Noor, Elad
2020-08-10
<p>Data files containing measured Gibbs free energies of reaction and formation (or electrostatic potential). This data is used by the component-contribution method to train the regression model that is used to estimate Gibbs free energies of many other biochemical reactions.</p>
https://doi.org/10.5281/zenodo.3978440
oai:zenodo.org:3978440
Zenodo
https://randr.nist.gov/enzyme/Default.aspx
https://doi.org/10.1371/journal.pcbi.1003098
https://gitlab.com/equilibrator/component-contribution
https://doi.org/10.5281/zenodo.3978439
info:eu-repo/semantics/openAccess
Creative Commons Attribution 4.0 International
https://creativecommons.org/licenses/by/4.0/legalcode
Training data for the component contribution method
info:eu-repo/semantics/other