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Investigating the Unbinding Mechanisms and Kinetics of MmpL3 Inhibitors: A Computational Study
<p>SMD compressed file: Initial structures and simulation setup files for the steered molecular dynamics simulations of the MmpL3-AU1235, MmpL3-BM212, MmpL3-NITD349, and MmpL3-SQ109 systems.</p>
ShareScore
16/100
Overall dataset sharing score
Score breakdown
These five areas show where the dataset supports — or may limit — practical reuse.
- Stewardship
- 4
- Harmonization
- 4
- Access
- 8
- Reuse readiness
- 0
- Engagement
- 0