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NMR-Based Fragment Screening in a Minimum Sample but Maximum Automation Mode
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Accurate Prediction of NMR Chemical Shifts in Macromolecular and Condensed-Phase Systems with the Generalized

Dongbo Zhao1,2, Ruiheng Song2, Wei Li1

  • 1Key Laboratory of Mesoscopic Chemistry of Ministry of Education, Institute of Theoretical and Computational Chemistry, School of Chemistry and Chemical Engineering, Nanjing University , Nanjing 210023, People's Republic of China.

Journal of Chemical Theory and Computation
|October 5, 2017
PubMed

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