Automation of biomolecular NMR screening
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Updated: Sep 27, 2026

09:19
NMR-Based Fragment Screening in a Minimum Sample but Maximum Automation Mode
Published on: June 4, 2021
1Hoffmann LaRoche AG, Department for Biostructural Research (PRBT), Grenzacher Str., CH-4070 Basel, Switzerland. alfred.ross@roche.com
Current Topics in Medicinal Chemistry
|February 7, 2003
Abstract:
For NMR based screening we review equipment needed for automated preparation of samples and acquisition of a large number of data sets. Hardware connecting lab-bench and NMR spectrometer is described. We focus on software used for automated calculation of the similarity between spectra - a prerequisite for the identification of test compounds interacting with a target-molecule.

