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Investigation of the behavior of dioxadet molecules in water by molecular dynamics

<p>A set of files for all-atom molecular dynamic simulations of a dioxadet molecule in water for four parametrizations obtained with a number of tools: ATBuilder, Amber tools, and Swiss Parameters.</p>

ShareScore

36/100

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
0

Topics

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