Useful chimera commands: Difference between revisions

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This command will color the selected atoms by there charge.
This command will color the selected atoms by there charge.
== Example Command-line script to save an image ==
open ../poses_clust_int.mol2
open ../rec.crg.pdb
surface #1
  color orange #1:.B
  color byhet,a #1:.B
  focus #0
  transp 80,s #1
  sop cap off
  set bg_color white
  unset depthCue
  set silhouette
set bg_color white
unset depthCue
set silhouette
focus #0
turn y 160
  turn x 20
~display
display #0.1
copy file ./C648_1.png png width 3840.0  height 1941.0 supersample 1
# this copy command will save the image, give the full path where you want to save the image
# you may want to ajust the width and height.
copy file C:\Users\user\Desktop\name\system\public_structures\complex/image25.png png width 801.0  height 849.0 supersample 1
Here are some tutorials:
*[[Chimera Tutorial (AMPC)]]
*[[Chimera Tutorial (Delta opioid receptor)]]

Latest revision as of 10:10, 24 March 2020

Command line

You might like to make a small molecules (eg. HEM) part of the surface of the protein instead of separate:

 surfcat one #1:1-290
 surf one probeRadius 1.4

You might want to color by partial charge:

 rangecolor charge,a min red 0 white max blue sel
 rangecolor charge,a -1.0 red 0.0 white 1.0 blue sel

This command will color the selected atoms by there charge.


Example Command-line script to save an image

open ../poses_clust_int.mol2
open ../rec.crg.pdb
surface #1
 color orange #1:.B
 color byhet,a #1:.B
 focus #0
 transp 80,s #1
 sop cap off
 set bg_color white
 unset depthCue
 set silhouette
set bg_color white
unset depthCue
set silhouette
focus #0
turn y 160
 turn x 20
~display
display #0.1
copy file ./C648_1.png png width 3840.0  height 1941.0 supersample 1
# this copy command will save the image, give the full path where you want to save the image
# you may want to ajust the width and height. 
copy file C:\Users\user\Desktop\name\system\public_structures\complex/image25.png png width 801.0  height 849.0 supersample 1

Here are some tutorials: