Print the shifts in individual atom positions: Difference between revisions

Print the shifts in individual atom positions (edit)

55 bytes added , 10 December 2010

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Revision as of 17:33, 3 July 2010 (edit) Pozharski (talk \| contribs) (Created page with 'This can be done with one command line (albeit a rather long one). Below is the code with (remove backslashes if pasting as a single line) grep 'ATOM\\|HETATM' file1.pdb file2.p…')		Revision as of 16:30, 10 December 2010 (edit) (undo) Pozharski (talk \| contribs) No edit summary Newer edit →
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	awk 'BEGIN {FIELDWIDTHS = "4 1 3 1 1 5 9"} {printf "%s %s %s %s %s\n", $3,$5,$6,$1,$7;}'		awk 'BEGIN {FIELDWIDTHS = "4 1 3 1 1 5 9"} {printf "%s %s %s %s %s\n", $3,$5,$6,$1,$7;}'


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