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Computer-assisted structure elucidation

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This is an old revision of this page, as edited by Schierbecker (talk | contribs) at 03:28, 14 April 2013 (Marcus Qwertyus moved page Computer assisted structure elucidation to Computer-assisted structure elucidation: compound modifier). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Computer assisted structure elucidation (or CASE) is the technique of using software to generate all possible molecular structures that are consistent with a particular set of spectroscopic data.[1]

See also

References

  1. ^ Jaspars, Marcel (1 January 1999). "Computer assisted structure elucidation of natural products using two-dimensional NMR spectroscopy†". Natural Product Reports. 16 (2): 241–248. doi:10.1039/A804433C. Retrieved 2 May 2012.
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