Re: [PyMOL] polar contacts involving F, Cl and S atoms

2008-07-26 Thread Thomas Evangelidis
I see what the abbreviations mean now, so stands for small overlap, bo for bad overlap, wc Van Der Wals contact, etc. They are at the left side of King's GUI. Sorry that was a naive question. Tom Tom, The simplest thing to do is just to use the dist command to check the interactions manual

Re: [PyMOL] polar contacts involving F, Cl and S atoms

2008-07-26 Thread Thomas Evangelidis
Thanks Bob. The kinemage generated by MolProbity is a good way to locate H-bond and not only. I guess "hb" in the list of contacts stands for H-bond, but I'm not quite sure what the other abbreviations stand for (cc, wc, so, etc.). This is the first time I use MolProbity and I've seen that

[PyMOL] polar contacts involving F, Cl and S atoms

2008-07-26 Thread Thomas Evangelidis
Hi Pymol users, I want to display the polar interactions between some ligands and a receptor, but I 'm not quite sure if Pymol can do that for F, Cl or S atoms. There's a tutorial on the wiki that explains how to set the cutoff distance but that refers only to O and N atoms: http://www.py

[PyMOL] Searching mailing list

2008-07-26 Thread Boon Hoe Lim
Hi, I have a problem - I can't seem to search your mailing list at sourceforge. I can browse it, but any search I do, such as "ray" or "objects" turns up no results. Is this an ongoing problem, or is it something my web browser might be experiencing? I'm using Mozilla Firefox, and have tried t