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Supplementary Material for "Model-Free Analysis of Experimental Residual Diploar Couplings in Small Organic Compounds"

<p>NMR Spectra (CLIP-HSQC, perfectCLIP-HSQC, TSE-PSYCHEDELIC) of isopinocampheol in six alignment conditions.</p> <p>Simulation input (experimental RDC data in six alignment media, input geometries, keywords) and output files (simulation / geometry trajectories, alignment data, SECONDA analysis) for isopinocampheol runs with the TITANIA software.</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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