Re: [PyMOL] Columb coloring

2018-06-27 Thread Joel Tyndall
It can easily be done in PyMOL Select your molecule, then in the right side select A(Action)->Generate->Vacuum Electrostatic Or there are plenty of tutorials on the web for APBS Hope this helps J From: Clarisa Alvarez Sent: Thursday, 28 June 2018 3:05 AM To: pymol-users@lists.sourceforge.ne

[PyMOL] Columb coloring

2018-06-27 Thread Clarisa Alvarez
Dir Sir/Madam, I need coloring my protein surface by electrostatic characteristics. Do I need to install APBS? because i could not do it. If you could help me it will be greatful. Thanks in advance, Yours, Clarisa. -- Check

Re: [PyMOL] Super and Align missing residues

2018-06-27 Thread Thomas Holder
Hi Nathan, Sounds like you are doing everything correct. Would it be possible to send me the input files? Thanks, Thomas > On Jun 26, 2018, at 10:58 AM, Nathan Clement wrote: > > Hi, > > I'm trying to compute the interface RMSD (iRMSD) between two protein pairs > that are highly similar (

[PyMOL] Capping clipped objects

2018-06-27 Thread Low, Harry H
I have an EM map which has been surface coloured in multiple different colours using the ramp_new command and follows the colour scheme of multiple fitted pdb chains using the ‘atomic’ special color function. I want to now slice my EM map to generate a cross section and then surface cap the inte

[PyMOL] Super and Align missing residues

2018-06-27 Thread Nathan Clement
Hi, I'm trying to compute the interface RMSD (iRMSD) between two protein pairs that are highly similar (might have a few missing residues, but are otherwise identical). Right now, my code does something like the following for protein pairs "gold" and "test" (receptor has chains A+B and ligand has