Conformational ensembles used in "Refining conformational ensembles of flexible proteins against SAXS data; Pesce F. and Lindorff-Larsen K."
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Conformational ensembles of Histatin5, Sic1, Tau generated with Flexible-meccano and converted to all-atom models with PULCHRA. TIA-1 ensemble from https://doi.org/10.1371/journal.pcbi.1007870 These ensembles have been used for SAXS calculations and reweighting against experimental SAXS data to study the effect of the hydration layer description on the reweighted ensembles.
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Zenodo创建时间：
2021-05-26
