Re: [COOT] Coot - symmetry operation label bug....

2010-12-01 Thread Paul Emsley

On 29/11/10 12:37, Mirek Gilski wrote:

Hi All,

I found a small but significant bug in Coot and WinCoot.

It is giving a wrong translation for symmetry related atoms.

I tested it on SO4 anion (S is on two fold axis); two symmetry related O atoms 
should be generated by
symmetry:  -y, -x, -z+1/2  plus translation (110) - space group P 43 21 2 .
Everything is ok, oxygen atoms have correct coordinates, except labels that 
showing (100) translation
instead (110) - both on status bar and in the atom label. I don't know how it 
is in different space groups.
   


What does

(origin-pre-shift imol)

(where imol is 0 typically/for example)

give you?


Re: [COOT] Installation problems: Coot for OS X - from CCP4 / Fink

2010-12-01 Thread Mark Brooks
Hi,
I'm not sure whether this is the problem, but have you updated X11 to a
recent Xquartz release? (http://xquartz.macosforge.org/trac/wiki). IIRC the
older ones gave problems.

I hope this helps.

Mark

On 1 December 2010 10:41, Antony Oliver antony.oli...@sussex.ac.uk wrote:

 Dear all,

 I am trying to install the latest version of Coot on OS X.  I have tried
 downloading the installer from CCP4, using Bill Scott's Fink pre-compiled
 binaries, and also using Fink to compile from source.  Unfortunately every
 time I try to run Coot I get the same error...

 ---
 Wed Dec  1 10:37:24  coot-real[17558] Error: unknown error code: invalid
 pixel format
 Wed Dec  1 10:37:24  coot-real[17558] Error: kCGErrorFailure: Set a
 breakpoint @ CGErrorBreakpoint() to catch errors as they are logged.
 The program 'coot-real' received an X Window System error.
 This probably reflects a bug in the program.
 The error was 'GLXBadContext'.
  (Details: serial 288 error_code 147 request_code 0 minor_code 3)
  (Note to programmers: normally, X errors are reported asynchronously;
   that is, you will receive the error a while after causing it.
   To debug your program, run it with the --sync command line
   option to change this behavior. You can then get a meaningful
   backtrace from your debugger if you break on the gdk_x_error() function.)
 ---

 Presumably there is a problem somewhere with one of the graphic library
 dependancies?
 Any help would be appreciated.

 Tony.

 = fink package is 0.6.2-pre-1-250 in the unstable tree of fink.
 = running OS X version 10.6.5


 ---
 Dr Antony W Oliver
 Senior Research Fellow
 CR-UK DNA Repair Enzymes Group
 Genome Damage and Stability Centre
 Science Park Road
 University of Sussex
 Falmer, Brighton, BN1 9RQ

 email: antony.oli...@sussex.ac.uk
 tel (office): +44 (0)1273 678349
 tel (lab): +44 (0)1273 677512



Re: [COOT] Installation problems: Coot for OS X - from CCP4 / Fink

2010-12-01 Thread William G. Scott
Dear Antony:

First, allow me to apologize for this.  I was hoping this would help make 
everything seamless.  

Mark Brooks suggested updating X11 from http://xquartz.macosforge.org/trac/wiki 
 .  Although this might help with such a problem on 10.5 with ppc., in this 
case I believe it shouldn't help, because on 10.6, this X11 doesn't get 
installed in the usual location, but instead somewhere in /opt  I think.  In 
any case, I don't use it on 10.6, so coot won't have been compiled using it, so 
installing it should neither help nor hurt.  Coot simply won't see it.

If coot does see it, it suggests you have the environment variable  
$DYLID_LIBRARY_PATH set.  (Doing so is a very bad idea.)

The short answer is I really don't know what is causing this problem.

I have two suggestions:

(1) Try building coot on your machine and see if it produces a working version. 
 It could be the old iMac I build these things on has some problem with its 
configuration or something.  

(2) Try installing my new pre-compiled stand-alone version from here:
http://sage.ucsc.edu/~wgscott/xtal/wiki/index.php/Stand-Alone_Coot#Version_0.6.2-pre-1-3250

Please let me know what happens.  After term ends (this week) I will have 
more time to devote to this.

Bill


PS:  Also, if you or anyone has run into a problem with coot on OS X, please 
put my email address in the To line and then I'll be sure to see it right 
away...


On Dec 1, 2010, at 2:41 AM, Antony Oliver wrote:

 Dear all, 
 
 I am trying to install the latest version of Coot on OS X.  I have tried 
 downloading the installer from CCP4, using Bill Scott's Fink pre-compiled 
 binaries, and also using Fink to compile from source.  Unfortunately every 
 time I try to run Coot I get the same error...
 
 ---
 Wed Dec  1 10:37:24  coot-real[17558] Error: unknown error code: invalid 
 pixel format
 Wed Dec  1 10:37:24  coot-real[17558] Error: kCGErrorFailure: Set a 
 breakpoint @ CGErrorBreakpoint() to catch errors as they are logged.
 The program 'coot-real' received an X Window System error.
 This probably reflects a bug in the program.
 The error was 'GLXBadContext'.
  (Details: serial 288 error_code 147 request_code 0 minor_code 3)
  (Note to programmers: normally, X errors are reported asynchronously;
   that is, you will receive the error a while after causing it.
   To debug your program, run it with the --sync command line
   option to change this behavior. You can then get a meaningful
   backtrace from your debugger if you break on the gdk_x_error() function.)
 ---
 
 Presumably there is a problem somewhere with one of the graphic library 
 dependancies?
 Any help would be appreciated.
 
 Tony.
 
 = fink package is 0.6.2-pre-1-250 in the unstable tree of fink.
 = running OS X version 10.6.5 
 
 
 ---
 Dr Antony W Oliver
 Senior Research Fellow
 CR-UK DNA Repair Enzymes Group
 Genome Damage and Stability Centre
 Science Park Road
 University of Sussex
 Falmer, Brighton, BN1 9RQ
 
 email: antony.oli...@sussex.ac.uk
 tel (office): +44 (0)1273 678349
 tel (lab): +44 (0)1273 677512