Frank Delaglio, Ph.D.

19804 Maycrest Way
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301 806-0867
delaglio@nmrscience.com



Scripts of the NMRPipe System
pdn2hms.tcl: Create Haigh-Mallion Ring Current Calculation Table from PDB.

Flag Argument Default Description
 -pdb pdbName ref.pdb PDB Input (for Sequence).
 -hms hmsName SURF_DIR/hmsRef.tab Haigh-Mallion Definitions.
 -seg segName Default New SEGNAME for Output. Use 'NONE' for No SEGNAME.
 -ignore Ignore SegName from PDB.