[PyMOL] Pymol and APBS

2010-07-20 Thread RaDaniel Christian 성준
Edited the subject. Thanks! On Tue, Jul 20, 2010 at 6:15 PM, RaDaniel Christian 성준 wrote: > I want to bring to your attention the wiki entry I posted in pymolwiki > regarding the default loading paths for apbs: > After installing with fink, none of the default paths work. > > http://pymolwiki.org

Re: [PyMOL] Pymol and APBS

2010-04-15 Thread Shiven Shandilya
Dear Michael, First, let me thank you for your time and effort in providing the community with your contributions. I do sincerely appreciate your hard work and your willingness to share it with us all. Without the contributions of users such as yourself, PyMOL's stature and utility would be far le

Re: [PyMOL] Pymol and APBS

2010-04-15 Thread Michael Lerner
On Thu, Apr 15, 2010 at 10:30 AM, Shiven Shandilya < shiven.shandi...@gmail.com> wrote: > Sorry to be knocking down APBS+PyMOL integration like this, but IMHO VASCo > does a stellar job as far as integrating outside programs with PyMOL goes. > > I initially wrote the PyMOL/APBS plugin for my own u

Re: [PyMOL] Pymol and APBS

2010-04-15 Thread Michael Lerner
Hi, Which version of PyMOL, APBS and PDB2PQR are you using? If you send me a PQR file off-list, I can take a closer look at what's going on. Thanks, -Michael On Thu, Apr 15, 2010 at 12:01 AM, J. Fleming wrote: > Hi all, > > I've been trying to get APBS Tools and/or APBSTools2 running for a

Re: [PyMOL] Pymol and APBS

2010-04-15 Thread Shiven Shandilya
Hi Jon, Perhaps you could look at VASCo http://genome.tugraz.at/VASCo/ I have found it to work extremely well on Windows and Linux platforms. You not only get electrostatics but also hydrophobic surface coloring, and all without the APBS and Python "hassles and headaches". Sorry to be knocking

[PyMOL] Pymol and APBS

2010-04-15 Thread J. Fleming
Hi all, I've been trying to get APBS Tools and/or APBSTools2 running for a few weeks now on multiple linux systems (RedHat and Fedora). I've Installed MALOC and APBS Tools. I can start up Pymol through Phenix, load a .pqr generated from a PDB2PQR server, start APBS Tools, set the grid, but whe