Scripts of the NMRPipe System
fixCS.tcl: Adjust a Chemical Shift Table for use in a TALOS/DYNAMO database.

Flag Argument Default Description  -in inName csObs.tab CS Input Table.  -out outName csAdj.tab CS Output, Adjusted.  -pdb pdbName ref.pdb Reference PDB File.  -sim simName csCalc.tab CS Simulation Output.  -keep frac 0.9 Fraction for Outlier Filtering.  -disu dist 3.0 Disulfide Bond Distance.  -cacb Allow Seperate CA and CB Adjustments.