遇见数据集

Protein Folding of Villin by Acellera

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Figshare2020-04-29 更新2026-04-08 收录
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Protein folding simulations of villin, provided by Acellera.<br>These simulations are analyzed in our tutorial: https://software.acellera.com/docs/latest/htmd/tutorials/protein-folding-analysis.html<br>Doerr, S.; Harvey, M. J.; Noé, F.; De Fabritiis, G. HTMD: High-Throughput Molecular Dynamics for Molecular Discovery. J. Chem. Theory Comput. 2016, 12, 1845–1852<br>

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2020-04-29
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