Data for "A computational protocol combining DFT and cheminformatics for prediction of pH-dependent redox potentials"
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Data published in the open access article "A computational protocol combining DFT and cheminformatics for prediction of pH-dependent redox potentials".<br>Each file is named after the name of a figure in the article and contains the final calculation results used to generate the figure.All methodologies are described in the article.
创建时间：
2021-06-29
