/CS2Structure

Tools for extracting structural information from NMR chemical shift data

Primary LanguageRMIT LicenseMIT

C2Structure: Extracting Structural Information Directly From NMR Chemical Shifts

  • cs2bps: R script to predict base-pairing status from chemical shifts
  • referencing_errors: R script to identify systematic chemical shift errors in observed chemical shifts
  • downloadSTR: bash script to download assigned chemical shifts from BMRB and reformat for CS2BPS predictor