The Molecular Graphics Laboratory Forum

AutoDock, AutoLigand, MGLTools, Vina, PyRx and more.
It is currently Sat May 18, 2013 1:22 pm

All times are UTC




Post new topic Reply to topic  [ 2 posts ] 
Author Message
PostPosted: Mon Sep 06, 2010 1:03 am 
Offline
Millimolar User
Millimolar User
User avatar

Joined: Mon Sep 06, 2010 12:57 am
Posts: 1
Hi there,

I am using MGL Tools v. 1.4.3 on Linux Cent OS.

Could someone please advice me if there is any way at all to change the background colour in the PMV ?

I can see how this can be done in the later versions; unfortunately though, 1.4.3 is the only one I was able to successfully run on our linux machine.

Thank you so much !


Top
 Profile  
 
PostPosted: Mon Feb 07, 2011 12:03 pm 
Offline
Millimolar User
Millimolar User
User avatar

Joined: Mon Feb 07, 2011 11:32 am
Posts: 1
Location: Virginia
Coloring by atom type
Jump to:
Adding missing hydrogens.

To gain a better understanding on the chemical structure of the molecule that we read, lets color this molecule by atom type.
To that end, click on Color → by Atom Type, check the Checkbutton next to lines and press OK. This colors our molecule using the following palette:

Hydrogens (H) - cyan
Carbons (C) - gray
Nitrogens (N) - blue
Oxygens (O) - red
Sulfurs (S) - yellow
Phospors (P) - magenta
All others - green

You could change PMV preferences so that all new molecules are colored by atom type. This is done by using File → Preferences → Set Commands to be Applied on Objects, which brings "Cmds called after adding an object" widget. Scroll down the list of "Available commands" and append colorByAtomType to "Commands to be applied" list.

If you need any additional information, I found this information here:

http://mgltools.scripps.edu/documentati ... -atom-type

Hope this helps.

JB


Top
 Profile  
 
Display posts from previous:  Sort by  
Post new topic Reply to topic  [ 2 posts ] 

All times are UTC


Who is online

Users browsing this forum: No registered users and 1 guest


You cannot post new topics in this forum
You cannot reply to topics in this forum
You cannot edit your posts in this forum
You cannot delete your posts in this forum
You cannot post attachments in this forum

Search for:
Jump to:  
cron
POWERED_BY
Translated by Maël Soucaze © 2009 phpBB.fr