Difference between revisions of "Useful chimera commands"
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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. | ||
+ | |||
Here are some tutorials: | Here are some tutorials: | ||
*[[Chimera Tutorial (AMPC)]] | *[[Chimera Tutorial (AMPC)]] | ||
*[[Chimera Tutorial (Delta opioid receptor)]] | *[[Chimera Tutorial (Delta opioid receptor)]] |
Revision as of 10:06, 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.
Here are some tutorials: