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Scrutinizing the protein hydration shell from molecular dynamics simulations against consensus small-angle scattering data (Simulation input files)

<p>Simulation input files for gromacs to reproduce the data from the manuscript &quot;Scrutinizing the protein hydration shell from molecular dynamics simulations against consensus small-angle scattering data&quot; (submitted to Comm. Chem.)</p>

ShareScore

40/100

Overall dataset sharing score

Score breakdown

These five areas show where the dataset supports — or may limit — practical reuse.

Stewardship
8
Harmonization
4
Access
16
Reuse readiness
8
Engagement
4

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