Title

High-throughput in Silico Structure Validation and Revision of Halogenated Natural Products Is Enabled by Parametric Corrections to DFT-Computed13C NMR Chemical Shifts and Spin–spin Coupling Constants

Publication Date

3-24-2017

Document Type

Article

Organizational Units

Chemistry and Biochemistry

Keywords

Carbon, Chemical structure, Molecular structure, Pharmaceuticals, Nuclear magnetic resonance spectroscopy

Publication Statement

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