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DP4 calculation: step 4
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Calculation of DP4 and assignment of structures
The program calculates how likely each calculated spectrum is to correspond to the experimental spectrum and assigns a probability to each.
Assigning Stereochemistry to Single Diastereoisomers by GIAO NMR Calculation: The DP4 Probability
S. G. Smith and J. M. Goodman J. Am. Chem. Soc. 2010, Accepted
DOI: 10.1021/ja105035r
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