Re: [PyMOL] Multiple molecules

2017-06-11 Thread Folmer Fredslund
Regards!! Em sáb, 10 de jun de 2017 às 10:48, Folmer Fredslund <folm...@gmail.com <mailto:folm...@gmail.com>> escreveu: Hi João, Yes and no. You can not (or only with a lot of to me unnecessary tweaks) make something like that in PyMOL. What you should do (

Re: [PyMOL] Segmentation fault

2017-03-29 Thread Folmer Fredslund
Hi João, On Ubuntu 16.04 (you didn't mention what you were running) with gcc-4.9 and "--use-msgpackc=no" I get a working pymol with revision 4170. Have you tried creating a new user and test pymol from that account? That should help you identify if it is solely a problem with your own

Re: [PyMOL] Video in Ubuntu Linux

2016-07-08 Thread Folmer Fredslund
Dear Ioannis, On 2016-07-08 09:04, Ioannis Michalopoulos wrote: > Dear PyMOL users, > > I use Kubuntu 14.04. I compiled PyMOL, following some instructions on the web. > This produced the directory: > > /opt/pymol-svn/ > > and a symbolic link to pymol executable: > > /usr/bin/pymol ->

Re: [PyMOL] Testing if a .pml script is run in command line mode

2016-02-02 Thread Folmer Fredslund
nder them by running PyMOL on the command line like this: pymol -c script.pml -r ray_scenes.py Thanks to Jesper Karlsen (off-list) for pushing a bit further with this and Tsjerk for introducing me to "invocation._argv" Best regards, Folmer 2016-02-01 15:19 GMT+01:00 Folmer Fredslund <

Re: [PyMOL] Testing if a .pml script is run in command line mode

2016-02-01 Thread Folmer Fredslund
GMT+01:00 Folmer Fredslund <folm...@gmail.com>: > Dear Tsjerk, > > Thanks! simply including > if '-c' in invocation._argv > in the script works fine for me, > > Best, > Folmer > > 2016-01-27 12:43 GMT+01:00 Tsjerk Wassenaar <tsje...@gmail.com>: &

[PyMOL] Testing if a .pml script is run in command line mode

2016-01-27 Thread Folmer Fredslund
(running the .pml normally) and also make raytraced png's when the .pml is being run in commandline mode. Best regards, Folmer Fredslund -- Site24x7 APM Insight: Get Deep Visibility into Application Performance APM + Mobile APM

Re: [PyMOL] Testing if a .pml script is run in command line mode

2016-01-27 Thread Folmer Fredslund
check combinations, so it would be matching > -.*c.* on the elements in _argv. > > There probably is a way to check for the GUI directly though. > > Hope it helps, > > Tsjerk > > On Wed, Jan 27, 2016 at 11:49 AM, Folmer Fredslund <folm...@gmail.com> > wrote:

Re: [PyMOL] color based on residue sequence

2015-12-06 Thread Folmer Fredslund
/lists.sourceforge.net/lists/listinfo/pymol-users > Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net > -- Folmer Fredslund -- Go from Idea to Many App Stores Faster with Intel(R) XDK

Re: [PyMOL] How to forbid merging of files?

2015-06-16 Thread Folmer Fredslund
-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- ___ PyMOL-users mailing list (PyMOL-users@lists.sourceforge.net) Info

Re: [PyMOL] sticks do not connect to the backbone

2015-05-18 Thread Folmer Fredslund
: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- One dashboard for servers and applications across Physical-Virtual-Cloud Widest out-of-the-box monitoring support with 50+ applications

Re: [PyMOL] Is Ball Stick models of molecules possible?

2015-04-23 Thread Folmer Fredslund
-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- BPM Camp - Free Virtual Workshop May 6th at 10am PDT/1PM EDT Develop your own process in accordance with the BPMN 2

Re: [PyMOL] Fetching PDBs; how to load .cifs provided instead of .pdbs

2015-03-20 Thread Folmer Fredslund
@lists.sourceforge.net -- Folmer Fredslund -- Dive into the World of Parallel Programming The Go Parallel Website, sponsored by Intel and developed in partnership with Slashdot Media, is your hub for all things parallel software

Re: [PyMOL] Selecting specific ligands for colouring

2015-01-06 Thread Folmer Fredslund
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Re: [PyMOL] Is it possible to move different subunits independently using Pymol

2014-11-17 Thread Folmer Fredslund
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Re: [PyMOL] PyMOL performance improvement

2014-11-07 Thread Folmer Fredslund
Dear Annalisa, Perhaps you should consider installing the nvidia driver instead of using nouveau? Venlig hilsen Folmer Fredslund Den 07/11/2014 04.07 skrev Annalisa Arcella annalisa.arce...@gmail.com: Hi All, I have installed PyMol by terminal sudo apt-get install pymol on my Ubuntu14.04

Re: [PyMOL] naming of chain id

2014-09-16 Thread Folmer Fredslund
://lists.sourceforge.net/lists/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- Want excitement? Manually upgrade your production database. When you want reliability

Re: [PyMOL] Coloring of helices

2014-08-22 Thread Folmer Fredslund
/ ___ PyMOL-users mailing list (PyMOL-users@lists.sourceforge.net) Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund

[PyMOL] Text in main windows missing with bg_color = white

2014-06-04 Thread Folmer Fredslund
pressing ESC). The text looks just fine if bg_color is black. Does anyone know if this is a feature or a bug? Best regards, Folmer -- Folmer Fredslund -- Learn Graph Databases - Download FREE O'Reilly Book Graph Databases

Re: [PyMOL] Text in main windows missing with bg_color = white

2014-06-04 Thread Folmer Fredslund
if this is a feature or a bug? it's not a feature, for sure. We'll fix that. OK, sounds great! Cheers, Thomas -- Thomas Holder PyMOL Developer Schrödinger, Inc. -- Folmer Fredslund -- Learn Graph Databases

Re: [PyMOL] Pseudo AxPyMol

2014-03-04 Thread Folmer Fredslund
://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- Subversion Kills Productivity. Get off Subversion Make the Move to Perforce. With Perforce, you get hassle-free workflows. Merge

Re: [PyMOL] Pymol 1.3 and 1.6 compatability?

2014-01-14 Thread Folmer Fredslund
Hi Lapolla, The PyMOL source is available here: http://sourceforge.net/projects/pymol/ Hope this helps, Folmer 2014/1/14 Lapolla, Suzanne M (HSC) suzanne-lapo...@ouhsc.edu I thought that 1.7 was not free--that you had to pay for it. Not true? If 1.7 is free, could you give me a link? Thank

Re: [PyMOL] rotate cell

2013-11-11 Thread Folmer Fredslund
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Re: [PyMOL] commands history

2013-11-10 Thread Folmer Fredslund
/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- November Webinars for C, C++, Fortran Developers Accelerate application performance with scalable

Re: [PyMOL] Making selections separately among 2 or more proteins loaded into PyMOL

2013-08-08 Thread Folmer Fredslund
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Re: [PyMOL] pymol windows gone

2013-03-21 Thread Folmer Fredslund
/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- Everyone hates slow websites. So do we. Make your web apps faster with AppDynamics Download

Re: [PyMOL] symmetry operation to generate the whole virus particle

2013-02-28 Thread Folmer Fredslund
: http://p.sf.net/sfu/appdyn_d2d_feb ___ PyMOL-users mailing list (PyMOL-users@lists.sourceforge.net) Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer

Re: [PyMOL] Write vector graphics of session

2013-01-15 Thread Folmer Fredslund
mailing list (PyMOL-users@lists.sourceforge.net) Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund

Re: [PyMOL] How to analyze and calculate tetramer interaction area and complexation energy

2012-11-13 Thread Folmer Fredslund
/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- Monitor your physical, virtual and cloud infrastructure from a single web console. Get in-depth

Re: [PyMOL] electron density map

2012-11-12 Thread Folmer Fredslund
understand correctly, what you are doing does not make any sense (I am a protein crystallographer...) To the best of my knowledge, what you are trying to do is not possible. With best intentions, Folmer On Sun, Nov 11, 2012 at 5:22 PM, Folmer Fredslund folm...@gmail.comwrote: Dear Amna

Re: [PyMOL] electron density map

2012-11-11 Thread Folmer Fredslund
/Autodock_plugin) by Daniel Seeliger. I would use that. Hope this helps Folmer Fredslund please help regards -- Everyone hates slow websites. So do we. Make your web apps faster with AppDynamics Download

Re: [PyMOL] Getting surface residues

2012-10-31 Thread Folmer Fredslund
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Re: [PyMOL] Select crystal waters inside protein

2012-10-04 Thread Folmer Fredslund
/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- Don't let slow site performance ruin your business. Deploy New Relic APM Deploy New Relic app performance

Re: [PyMOL] Saving setting in PyMol

2012-08-16 Thread Folmer Fredslund
/114/50122263/ ___ PyMOL-users mailing list (PyMOL-users@lists.sourceforge.net) Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund

Re: [PyMOL] Messed up structures in movie

2012-05-23 Thread Folmer Fredslund
://lists.sourceforge.net/lists/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net -- Folmer Fredslund -- Live Security Virtual Conference Exclusive live event will cover all

Re: [PyMOL] Messed up structures in movie

2012-05-23 Thread Folmer Fredslund
that the structure is not right. I didn't see much details though, except that the atom connections seem to be wrong. Thanks, Ritu On 05/23/12, Folmer Fredslund wrote: Hi Ritu, Could you elaborate on some of the ligand structures get completely messed up when viewed as sticks or lines

Re: [PyMOL] creating PDB structure

2011-11-23 Thread Folmer Fredslund
On 11/23/2011 01:18 PM, James Starlight wrote: Thanks Thomas! Those scripts works fine. Could you tell me if there any way to install all of those scripts as the pymol plugins ( that I need not to load this scripts every time when I sttart pymol de novo )? James Hi James Jason Vertrees

Re: [PyMOL] How to label a cartoon representation?

2011-10-30 Thread Folmer Fredslund
your coloured helices as selections you could do something like: zoom helix1 pseudoatom labelhelix1 label labelhelix1, Helix 1 The position of the label can be changes using the edit mode (see e.g. http://pymolwiki.org/index.php/MovieSchool_3#Mouse_Modes) Hope this helps Best regards, Folmer

Re: [PyMOL] SURFACE MODEL

2011-07-17 Thread Folmer Fredslund
gray. This is done on the command-line. You can also use the gui (top right there is a multicolored square with the letter C, for color) and select many different colors. This can be done for all or individually for each object/pdb you load. Hope this helps! Best regards, Folmer Fredslund 2011/7

Re: [PyMOL] Spectrumany bug?

2011-04-05 Thread Folmer Fredslund
Dear Tassos 2011/4/5 Anastassis Perrakis a.perra...@nki.nl: Hi - I am trying to use the script by Thomas Holder, Spectrumany http://www.pymolwiki.org/index.php/Spectrumany Very nice that you link to the program you use, but possibly someone is going to ask about the PyMOL version ;-)

Re: [PyMOL] using pymol from python script

2011-02-17 Thread Folmer Fredslund
png mymolecule.png Then do like this pymol -c example.pml And you get mymolecule.png Best regards, -- Folmer Fredslund -- The ultimate all-in-one performance toolkit: Intel(R) Parallel Studio XE: Pinpoint memory

Re: [PyMOL] Newbie question

2010-10-29 Thread Folmer Fredslund
! Best regards, Folmer Fredslund 2010/10/29 Prince, D Bryan dbryan.pri...@astrazeneca.com: Dear PyMOL users: I have been working my way through a tutorial on how to use PyMOL, and working primarily from the command line. Being somewhat schooled in UNIX, I ran into a problem and typed help show

Re: [PyMOL] print quality pictures

2010-07-15 Thread Folmer Fredslund
regards, Folmer Fredslund -- Thank you and Regards, Vivek -- This SF.net email is sponsored by Sprint What will you do first with EVO, the first 4G phone? Visit sprint.com/first -- http://p.sf.net/sfu/sprint-com-first

Re: [PyMOL] sequence conservation alignment onto structure

2010-06-04 Thread Folmer Fredslund
strongly advise you to have a look at ALINE: http://crystal.bcs.uwa.edu.au/px/charlie/software/aline/ Here you can color the alignment and export the colors to a PyMOL script. This is at least one way to do it. Best regards, Folmer Fredslund Thanks in advance -- Best Regards, Humayun Sharif

Re: [PyMOL] Mutagenesis tool failing on rotameric amino acids

2010-05-24 Thread Folmer Fredslund
of them. # select remove all non A altlocs remove not (alt ''+A) # reset the PDB information alter all, alt='' taken from: http://pymolwiki.org/index.php/Property_Selectors#Alternate_Locations I hope this helps. Folmer Fredslund

Re: [PyMOL] echoing command line history

2010-03-18 Thread Folmer Fredslund
earlier on, but this has worked nicely for me everytime I've used it. You don't mention what OS you are using, but the pwd command will give you your current path (at least on linux) and it should be relatively easy to find the output file afterwards. Best regards, Folmer Fredslund Thanks

Re: [PyMOL] how to run the script file in pymol

2010-02-06 Thread Folmer Fredslund
Hi John, Please be aware that there is a difference between a python script that allows you to define some functionality you can use in PyMOL (usually with a .py ending), and a script that will read coordinates and do some PyMOL stuff (which I usually apply a .pml ending). So, what I think is

Re: [PyMOL] Regarding Object Find

2009-10-26 Thread Folmer Fredslund
– sequence function. Is there any script to/load/select/highlight specific molecule from one object? Please reply back I don't think you need a script to do this. Look into this link http://pymolwiki.org/index.php/States and I think you will understand. Best regards, Folmer Fredslund

Re: [PyMOL] Viewport dimensions query

2009-09-24 Thread Folmer Fredslund
Hi Carsten, Is this what you are looking for? http://www.mail-archive.com/pymol-users@lists.sourceforge.net/msg05888.html Best regards, Folmer Fredslund 2009/9/24 Schubert, Carsten [PRDUS] cschu...@its.jnj.com: Hi, Does anyone know how to  get a hold of the viewport dimensions from within

[PyMOL] Getting ranges from selections

2009-09-02 Thread Folmer Fredslund
that will work on your normal linux distribution would make me happy. Best regards, Folmer Fredslund -- Let Crystal Reports handle the reporting - Free Crystal Reports 2008 30-Day trial. Simplify your report design, integration

Re: [PyMOL] Label coordinates

2009-07-10 Thread Folmer Fredslund
a to do item. Cheers, Warren -Original Message- From: Folmer Fredslund [mailto:folm...@gmail.com] Sent: Thursday, July 09, 2009 6:33 AM To: pymol-users@lists.sourceforge.net Subject: [PyMOL] Label coordinates Dear all, Is there a way to get the coordinates for manually shifted

[PyMOL] Label coordinates

2009-07-09 Thread Folmer Fredslund
Dear all, Is there a way to get the coordinates for manually shifted labels? What I want to do is to include the label positions in my script instead of moving the labels each time I update my figure. Thanks in advance, Folmer Fredslund

Re: [PyMOL] surface area calculation

2009-04-21 Thread Folmer Fredslund
found something like this: http://pymolwiki.org/index.php/Get_Area I hope this is what you are looking for? Best regards, Folmer Fredslund

Re: [PyMOL] Saving figures for publication

2009-03-13 Thread Folmer Fredslund
Dear Abhinav 2009/3/13 Abhinav Kumar abhin...@slac.stanford.edu: Hi, I need to make figures in tiff format with at least 600 dpi resolution as required by the journal. The default resolution in Pymol figures is 72. Is there a simple way to increase the resolution (and save it in tiff

Re: [PyMOL] Newbie Questions: Sequence Bar breaks vs gaps? Residue NAG? HOH?

2008-10-13 Thread Folmer Fredslund
Hi Massimo 2008/10/13 Massimo Heitor massimohei...@gmail.com: I am looking at the residue sequence for a protein that I'm studying for a class and I have a few questions. I understand the regular amino acid codes (CYS, ARG, LEU, etc...). What is NAG? I see one sequence NAG NAG NAG NAG

Re: [PyMOL] Electron density map in pymol

2008-09-26 Thread Folmer Fredslund
=/ ___ PyMOL-users mailing list PyMOL-users@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/pymol-users -- Folmer Fredslund Kantatgatan 84 21570 Malmö Sverige Tlf.: (+46) 40 66 72 194 Mobil: (+45) 61 468 009 Mail: folm...@gmail.com MSN: folm...@gmail.com

Re: [PyMOL] Electron density map in pymol

2008-09-26 Thread Folmer Fredslund
try the help function: help load help isomesh help color hope this helps On Fri, Sep 26, 2008 at 5:42 PM, Folmer Fredslund folm...@gmail.com wrote: 2008/9/26 Jhon Thomas jhon1.tho...@gmail.com: Hello all pymol users I am new to pymol and trying to open a .xplor map file in pymol to get