Re: [ccp4bb] OMIT map from Sfcheck

2008-04-09 Thread Jovine Luca

On 7 Apr 2008, at 21:28, Michael Giffin wrote:


my model has 1600 atoms.  the memory allocation for the linux (worked)
and OS X (failed) binaries is the same:

 Sol_
 Sol_   -
 Sol_   --- SFCHECK --- /Vers 7.2.02; 01.10.2006/   -
 Sol_  Memory:   30 Mb  N_atom_max:  5  -
 Sol_   -
 Sol_

compiling from source or downloading the mac intel binary worked  
with no errors.


Hi Mike,

Then I guess the reason must be that some other OS X-specific issue  
was fixed between sfcheck versions 7.2.02 and 7.02.4; but, in any  
case, this message from the program's author points to the location  
of the latest version:



Begin forwarded message:


From: Alexei Vagin [EMAIL PROTECTED]
Date: 4 April 2008 11:33:56 GMT+02:00
To: Jovine Luca [EMAIL PROTECTED]
Cc: CCP4BB@jiscmail.ac.uk
Subject: Re: [ccp4bb] OMIT map from Sfcheck

Please try to use sfcheck binaries  or source code from my home page:

http://www.ysbl.york.ac.uk/~alexei/sfcheck.html

Regards
Alexei


Hopefully updating to this will fix your problem!
Good luck,

Luca

Re: [ccp4bb] OMIT map from Sfcheck

2008-04-07 Thread Michael Giffin
my model has 1600 atoms.  the memory allocation for the linux (worked)
and OS X (failed) binaries is the same:

 Sol_
 Sol_   -
 Sol_   --- SFCHECK --- /Vers 7.2.02; 01.10.2006/   -
 Sol_  Memory:   30 Mb  N_atom_max:  5  -
 Sol_   -
 Sol_

compiling from source or downloading the mac intel binary worked with no errors.

Thanks,

Mike

On Fri, Apr 4, 2008 at 1:58 AM, Jovine Luca [EMAIL PROTECTED] wrote:
 On 4 Apr 2008, at 01:36, Michael Giffin wrote:


  i get the same error on OS X 10.5.2 and 10.4.11:
 
 
   sfcheck -f refmac2.mtz -m refmac2.pdb -out y -nomit 2 -map
  
 
  the error:
  
   Open failed: Unit:  11, File: sfcheck_scr.dat (logical: sfcheck_scr.dat)
  BFONT COLOR=#FF!--SUMMARY_BEGIN--
  Last system error message: Bad file descriptor
   CCP4:   Open failed: File: sfcheck_scr.dat
   CCP4:   Open failed: File: sfcheck_scr.dat
  
 
  the binary file sfcheck_scr.dat exists.
 


  Hi Mike,

  I encountered the same exact issue under OS X not long ago, and it turned
 out to be caused by memory/atom limitations of Fink's sfcheck (I assume
 that's what you are using?):

  Sol_   --- SFCHECK --- /Vers 7.2.02; 01.10.2006/   -
  Sol_  Memory:   30 Mb  N_atom_max:  5  - = !!!

  so that using the sfcheck binary included with BALBES:

 Sol_ --- SFCHECK --- /Vers 7.02.4; 02.05.2007/ -
 Sol_ Memory: 60 Mb N_atom_max: 10 -

  solved the problem. How many atoms are you playing with?

  HTH, Luca

  
  Luca Jovine, Ph.D.
  Karolinska Institutet
  Department of Biosciences and Nutrition
  Hälsovägen 7, S-141 57 Huddinge, Sweden
  Voice: +46.(0)8.6083-301  FAX: +46.(0)8.6089-290
  E-mail: [EMAIL PROTECTED]
  W3: http://ki.se
  



[ccp4bb] OMIT map from Sfcheck

2008-03-27 Thread Kristof Van Hecke

Dear,

I'm intending to make an OMIT map using Sfcheck (ccp4i 6.0.2, Mac OS  
X Tiger, PPC).

However, the program terminates with:

has failed with error message
1525-005
1525-005
1525-005
1525-005
1525-005
1525-005


When using 'command line' from a script (with '-nomit 2 -map -origin - 
out y') I got:


Last system error message: No such file or directory
CCP4:   Open failed: File: /Users/kristof/data/11mer/data2/ 
sfcheck_scr.dat



Does anyone know this problem please..?

Many thanks

Kristof


--
Kristof Van Hecke, PhD
Biomoleculaire Architectuur
Celestijnenlaan 200 F
B-3001 Heverlee (Leuven)
Tel: +32(0)16327477
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