Measure Distance: Difference between revisions
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# out to the file "dist.txt" | # out to the file "dist.txt" | ||
# Simply change your selections to see different distances. | # Simply change your selections to see different distances. | ||
# import PyMOL's command namespace | |||
from pymol import cmd | from pymol import cmd | ||
# open dist.txt for writing | |||
f=open('dist.txt','w') | f=open('dist.txt','w') | ||
# calculate the distance and store it in dst | |||
dst=cmd.distance('tmp','mol1///25/ha','mol1///26/ha') | dst=cmd.distance('tmp','mol1///25/ha','mol1///26/ha') | ||
# write the formatted value of the distance (dst) | |||
# to the output file | |||
f.write("%8.3f\n"%dst) | f.write("%8.3f\n"%dst) | ||
# close the output file. | |||
f.close() | f.close() | ||
</source> | </source> | ||
Revision as of 02:05, 23 February 2007
# This script writes the distance from
# atom mol1///25/ha to atom mol1///26/ha
# out to the file "dist.txt"
# Simply change your selections to see different distances.
# import PyMOL's command namespace
from pymol import cmd
# open dist.txt for writing
f=open('dist.txt','w')
# calculate the distance and store it in dst
dst=cmd.distance('tmp','mol1///25/ha','mol1///26/ha')
# write the formatted value of the distance (dst)
# to the output file
f.write("%8.3f\n"%dst)
# close the output file.
f.close()