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Re: [ccp4bb]: Grasp surface
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grasp -n starts in the command line.
use
grasp -n -rx mygraspcommands.gs
to read in a command list. Below are the commands to build surface on 1btk
chains A and B, no waters. Writing out I can't recall, and can't test as
our grasp is "broken"
Hope this helps, Marko
Macro Name: Surface
write:**********************************************
write:
write:
write: Read in coordinates
write:
write:
write:**********************************************
Menu Cascade Begin
menu :GRASP | Read
menu :Read Submenu | PDB File
menu :Enter/List | Enter File Name
line :1btk.pdb
Menu Cascade End
write:**********************************************
write:
write:
write: Create a surface
write:
write:
write:**********************************************
Menu Cascade Begin
menu :GRASP | Calculate
menu :Calculate Submenu | Area of a Surface/Molecule
menu :What Surface/Molecule? | Molecule
menu :Type of Area | Accessible Area
menu :Which Atoms | Enter String
line :ch=A,B, r=-wat
Menu Cascade End
Macro End