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Development of a 13C NMR Chemical Shift Prediction Procedure Using B3LYP/cc-pVDZ and Empirically Derived Systematic Error Correction Terms: A Computational Small Molecule Structure Elucidation Method

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Description scientific article published on 11 April 2017
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author: Christofer S. Tautermann  Keith R Fandrick 

Publication date April 11, 2017
Language English
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