Category:Script Library: Difference between revisions

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* [[Transform_odb]] -- Transform a selection of an existing object and output as a new object.  The transformation matrix is read from an "O"-style tranformation matrix file (.odb) written by "O" or by any of the Uppsala Software Factory programs (from Gerard Klegweit) such as LSQMAN.
{| style="text-align: left; background: #D9CEB2; color: #7A6A53; border: 2px solid #D5DED9; padding: 3em;" align="center"
 
|-
* [[Stereo_Ray]] -- This script will create two resolution specific ray traced images rotated appropriately for inclusion into a single file to represent a stereo view of the desired macromolecule.
! style="padding-top: 1em; padding-bottom: 2.5em; font-size: 1.25em; text-align: center;" |
 
! style="padding-top: 1em; padding-bottom: 2.5em; font-size: 2.5em; text-align: center;" |  PyMOL Script Library
* [[Translate_And_Measure]] -- prints '''overlap''' if any of the atoms in molA or molB were within 4 Angstrom after translating by 1 along X
! style="padding-top: 1em; padding-bottom: 2.5em; font-size: 1.25em; text-align: center;" |
 
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* [[Show aromatics]] -- This script will display a backbone "worm" for your protein, with all of the sidechains for aromatic residues displayed as green "sticks". Usage: Save this as "show_aromatics.pml", load your protein in PyMOL, and run the script (select "Run" from the "File" menu). (PyMOL script; TStout)
! style="padding-bottom: 4em; font-size: 1.25em; text-align: center;" |  [[Running_Scripts|Running Scripts]]
 
! style="padding-bottom: 4em; font-size: 1.25em; text-align: center;"| [[Category_talk:Script_Library#Requests|Script Requests]]  
* [[Show hydrophobics]] -- This script will display a backbone "worm" for your protein, with all of the sidechains for hydrophobic residues displayed as orange "sticks". Usage: Same as "show aromatics". (PyMOL script; TStout)
! style="padding-bottom: 4em; font-size: 1.25em; text-align: center;"| [[Category_talk:Script_Library#Policy|Policy]]
 
|-
* [[Show charged]] -- This script will display a backbone "worm" for your protein, with all of the sidechains for charged residues displayed as red (negative) or blue (posititve) "sticks". Usage: Same as "show aromatics". (PyMOL script; TStout)
! style="font-size: 1.25em; " | [[:Category:Structural_Biology_Scripts|Structural Biology]]
 
! style="font-size: 1.25em; " | [[:Category:ObjSel_Scripts|Objects and Selections]]  
* [[Show hydrophilic]] -- This script will display a backbone "worm" for your protein, with all of the sidechains for hydrophilic residues displayed as green "sticks". Usage: Same as "show aromatics". (PyMOL script; TStout)
! style="font-size: 1.25em; " | [[:Category:Math_Scripts|Math/Geometry/CGO]]
 
|- valign=top
* [[Perp Maker]] -- Creates a perpendicular plane through the center of your protein with respect to the camera's current position. (If you translate the protein towards the camera a bit, you get a nice surface, sometimes.) A stupid little script I wrote in response to a request a few months ago (and it doesn't even conform to the request!)  Load a protein, run the script (read the documentation in the script). (Jason Vertrees/[[User:Tree|Tree]])
|<DPL>
 
category=Structural_Biology_Scripts
* [[Axes]] -- Creates a 3D-CGO object that shows the three coordinate axes.
redirects=include
 
mode=unordered
* [[CGO Text]] -- Creates a 3D-CGO text object.
format = <ul type="disc">,<li>[[%PAGE%]],</li>,</ul>
 
</DPL>
* [[List Selection]] -- Prints a list of all residues in a selection (both Python and .pml).
||
 
<DPL>
* [[List Colors]] -- Lists the color of all residues in a selection (both Python and .pml).
category=ObjSel_Scripts
 
redirects=include
* [[List Secondary Structures]] -- Secondary structures (both predefined and those calculated with the 'dss' command) can be exported as a long string ('HHHHLLLLSSS').
mode=unordered
 
format = <ul type="disc">,<li>[[%PAGE%]],</li>,</ul>
* [[Split Movement]] -- Moves two parts of one object into different directions.
</DPL>
 
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* [[Selection Exists]] -- Python method that returns true if a selection of a given name exists.
<DPL>
 
category=Math_Scripts
* [[Get Coordinates I]] -- Retrieves atom coordinates as Python objects.
redirects=include
 
mode=unordered
* [[Get Coordinates II]] -- Retrieves atom coordinates as Python array (list object).
format = <ul type="disc">,<li>[[%PAGE%]],</li>,</ul>
 
</DPL>
* [[grepset]] -- List all settings matching a given keyword. - ''by EHP''
|-
 
! style="font-size: 1.25em; padding-top: 3.5em; width:33%;" | [[:Category:UI_Scripts|User Interface]]
* [[disconnect]] -- unbond a single atom from its neighbors. - ''by EHP''
! style="font-size: 1.25em; padding-top: 3.5em; width:33%;" | [[:Category:Biochemical_Scripts|Biochemical Scripts]]
 
! style="font-size: 1.25em; padding-top: 3.5em; width:33%;" | [[:Category:System_Scripts|System Scripts]]
* [[mouse_modes]] -- customize the default mouse bindings for Viewing or Editing modes. - ''by EHP''
|- valign=top
 
|<DPL>
* [[Measure Distance]] -- Measures the distance between two atoms (Python script).
category=UI_Scripts
 
redirects=include
* [[Read PDB-String]] -- Parses a string in PDB format to a PyMOL object.
mode=unordered
 
format = <ul type="disc">,<li>[[%PAGE%]],</li>,</ul>
* [[Color Objects]] -- Colors all objects differently (Python script).
</DPL>
 
||
* [[Key Wait]] -- Process key events in a Python script.
<DPL>
 
category=Biochemical_Scripts
* [[Bounding Box]] -- Create a bounding box around a selection (Python script; requires numarray and Scientific; gilleain)
redirects=include
 
mode=unordered
* [[Ellipsoid]] -- Create callback object (opengl) ellipsoids. (Python script; gilleain)
format = <ul type="disc">,<li>[[%PAGE%]],</li>,</ul>
 
</DPL>
* [[pdbsurvey]] -- Surveys the pdb for recently added structures that are relevant to a user-specified keywords list (in a text file)
||
 
<DPL>
* [[TransformSelectionByCameraView]] -- Transforms the selection by the camera view.
category=System_Scripts
 
redirects=include
* [[WFMesh]] -- Imports wavefront object mesh files; Starwars as an example!
mode=unordered
 
format = <ul type="disc">,<li>[[%PAGE%]],</li>,</ul>
* [[grepsel]] -- Make named selections using regular expressions (protein sequence).
</DPL>
|-
! style="font-size: 1.25em; padding-top: 3.5em; width:33%" | [[:Category:ThirdParty_Scripts|Third Party]]
! style="font-size: 1.25em; padding-top: 3.5em; width:33%;" |
! style="font-size: 1.25em; padding-top: 3.5em; width:33%;" |
|- valign=top
|<DPL>
category=ThirdParty_Scripts
redirects=include
mode=unordered
format = <ul type="disc">,<li>[[%PAGE%]],</li>,</ul>
</DPL>
|}


[[Category:Scripting|Script Library]]
[[Category:Scripting|Script Library]]

Latest revision as of 11:07, 14 December 2011

PyMOL Script Library
Running Scripts Script Requests Policy
Structural Biology Objects and Selections Math/Geometry/CGO
User Interface Biochemical Scripts System Scripts
Third Party

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