Published October 4, 2021 | Version v1.6.46
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TITANIA Model-Free Interpretation of Residual Dipolar Couplings in the Context of Organic Compounds

  • 1. Technische Universität Darmstadt


TITANIA is a program package to directly extract structure and dynamics parameters from Residual Dipolar Couplings for weakly aligned organic compounds using an iterative model-free approach. RDC data from multiple alignment sets are analyzed to jointly determine the conformation and configuration of organic compounds.



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Preprint: 10.26434/chemrxiv.14636070.v1 (DOI)
Preprint: 10.26434/chemrxiv.14636316.v1 (DOI)