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Main Author: Jiang, Xinyu
Format: Recurso digital
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Published: Zenodo 2026
Online Access:https://doi.org/10.5281/zenodo.20305751
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author Jiang, Xinyu
author_facet Jiang, Xinyu
contents <p>Our paper: Deep Residual Learning for Molecular Force Fields (Under Review)</p> <p><strong>Gen2-Opt.zip</strong> contains Gen2 Optimization training data, including xyz/hdf5 format and dgl graphs.</p> <p><strong>DES370K.zip</strong> contains dimer training data extracted from SPICE-1.1.4, including xyz format and dgl graphs.</p>
format Recurso digital
id zenodo_https___doi_org_10_5281_zenodo_20305751
institution Zenodo
language
publishDate 2026
publisher Zenodo
record_format zenodo
spellingShingle Training data of ResFF
Jiang, Xinyu
<p>Our paper: Deep Residual Learning for Molecular Force Fields (Under Review)</p> <p><strong>Gen2-Opt.zip</strong> contains Gen2 Optimization training data, including xyz/hdf5 format and dgl graphs.</p> <p><strong>DES370K.zip</strong> contains dimer training data extracted from SPICE-1.1.4, including xyz format and dgl graphs.</p>
title Training data of ResFF
url https://doi.org/10.5281/zenodo.20305751