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
  13840 Grey Colt Drive
  North Potomac MD 20878 USA


  Tel: 301 806-0867
  Fax: 301 309-8717
  E-mail: delaglio@nmrscience.com



NMRPipe Processing Functions
QART: Scaling for Quad Artifacts.

Flag Argument Default Description
 -a aVal 0.0 Amplitude Adjustment.
 -f fVal 0.0 Phase Adjustment.
Automatic Value Determination:
 -auto Find a and f Values Automatically Via Grid Search.
Freq-Domain Region for Auto Mode:
 -x1 xLoc1 1 First Point to Use.
 -xn xLocN SIZE Last Point to Use.
 -y1 xLoc1 1 First Slice to Use.
 -yn yLocN Y1 Last Slice to Use.
Time-Domain Region for Auto Mode:
 -head skipPts 0 Points to Skip.
 -size tSize SIZE Points to Use.
Grid Search Parameter Limits for Auto Mode:
 -aMin -0.01 Minimum A Value.
 -aMax +0.01 Maximum A Value.
 -aCnt 16 A Increment Count.
 -fMin -0.01 Minimum F Value.
 -fMax +0.01 Maximum F Value.
 -fCnt 16 F Increment Count.
Formula:
  R' = R
  I' = (1+a)*I + f*R

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last updated: Apr 20, 2011 / big frank

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