Supplementary Material for "TITANIA Model-Free Interpretation of Residual Dipolar Couplings in the Context of Organic Compounds"
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Simulation input (RDC data, input geometries, keywords) and output files (simulation / geometry trajectories, alignment data, SECONDA analysis) for isopinocampheol, tubocurarine and strychnine runs with the TITANIA software.
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Zenodo创建时间：
2021-10-08
