KIEA-IRES Exploration II: Morris Sensitivity-analysis-driven Refinement
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https://zenodo.org/record/10020754
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资源简介：
This repository contains the data for the automated reaction network exploration of the Eschemoser-Claisen rearrangements of allyl alcohol and furfuryl alcohol using Morris sensitivity analysis as a measure for the targeted network refinement, as presented in
Bensberg, M.; Reiher, M., Uncertainty-aware First-principles Exploration of Chemical Reaction Networks, **2023** arXiv, DOI: 10.48550/ARXIV.2312.15477.
创建时间：
2024-05-15
