Welcome: an Introduction to this Site
NMRPipe: a Comprehensive Software System for Biomolecular NMR
Special Applications: NMR Drug Screening, Automation, and so on
Dipolar Couplings, Chemical Shifts, and Protein Structure
Miscellaneous

Frank's CV, Recent Slides, and Thesis

 

 

 

  Frank Delaglio, Ph.D.

  Software Science Consultant
  325 Union Avenue #212
  Campbell CA 95008 USA


  Tel: 301 806-0867
  E-mail: delaglio@nmrscience.com



Scripts of the NMRPipe System
talos2dyn.tcl: Convert TALOS prediction output to DYNAMO Torsion Table.

Flag Argument Default Description
 -in talosName pred.tab TALOS Prediction Output.
 -seg segName None Default Seg Name.
 -id firstID 1 First Restraint ID.
 -fc forceConst 1.0 Force Constant Value.
 -dPhiMin pMin 0.0 Minimum Value for DPHI Input.
 -dPsiMin pMin 0.0 Minimum Value for DPSI Input.
 -f factor 2.0 Factor for +/- Angle Range.
 -hdr Print Header (Default).
 -nohdr No Header.
 -keepBad Use All TALOS Predictions.
Sequence Info (Use Only One):
 -cs csName None TALOS Chemical Shift Table Input.
 -pdb pdbName None PDB Input File.

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last updated: Jul 4, 2012 / big frank

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