[PyMOL] pqr file

2006-04-11 Thread Chun Tang
Hi there, When one uses the APBS plugin of pymol to generate a pqr file, how dose it assign the partial charges to the atoms, what force field is it based on? Thank you. Chun

[PyMOL] Re: pqr file

2006-04-12 Thread Chun Tang
erent for the pqr file of the same structure generated on pdb2pqr server. My question is how does pymol assign partial charges? I can only find a file called apbs_tools.py under the directory of ./modules/pmg_tk/startup/ that remotely has some information. Chun On 4/11/06, Chun Tang wrote: > &g

[PyMOL] isomesh for electrostatic potential

2006-04-18 Thread Chun Tang
Dear PyMoler, In the pymol apbs tool, there is an option to show the negative/positive isosurface (not the molecular surface) upon loading an electrostatic map. My question is if there is a way to show the electrostatic potential surface as mesh instead of solid surface, also if it is possible to

[PyMOL] cylindrical representation

2008-08-18 Thread Chun Tang
Dear all, I don't know if this has been discussed before. I noticed that the structure is completely wrong when I have cylindrical representation of helices turned on. This happens when I have multiple structures loaded up - rendering of single pdb file seems all right. I am using version 1.1 on

[PyMOL] electrostatic surface

2002-07-12 Thread Chun Tang
Hi, I know pymol can do surface. I want to know if the new release of pymol 0.83 can show electrostaic surface. Thanks. Chun