zenodoopen
Supporting Data for "Actively Searching: Inverse Design of Novel Molecules with Simultaneously Optimized Properties" Manuscript
<p>Training data and xTB calculated properties of sampled structures from the generative active learning experiments reported in the manuscript.</p>
ShareScore
32/100
Overall dataset sharing score
Score breakdown
These five areas show where the dataset supports — or may limit — practical reuse.
- Stewardship
- 4
- Harmonization
- 4
- Access
- 16
- Reuse readiness
- 8
- Engagement
- 0
ScienceDex for faculty
Your academic CV and NIH biosketch
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