[sharp-discuss] Error in CAD during ARP/wARP on a mac - using example file krel1-SAD

[Clemens Vonrhein]

Hi,

the latest SHARP/autoSHARP should run happily with the old ARP/wARP
6.1.1 or the latest 7.0.1. Are you running one of those?

Cheers

Clemens


On Sun, Dec 13, 2009 at 08:33:37AM -0500, Narayanan Ramasubbu wrote:
> Hi:
> I am trying run sharp/autoSHARP on a mac (os x 10.4) using the guven 
> example file: krel1-SAD.0
> I am getting an error at the CAD as provided below
> ++++++++++++++++++++++
> The parameter file is: 
> /Users/subbu/sharp/sharpfiles/logfiles_local/krel-SAD.1/wARP_49.4pc/20091213_080749/arp_warp_tracing.par
> 
> Entering warp_tracing.sh from the command line
> The working directory is: 
> /Users/subbu/sharp/sharpfiles/logfiles_local/krel-SAD.1/wARP_49.4pc/20091213_080749
> 
> ARP/wARP will run in the subdirectory: temp_tracing
> 
> Building free atoms model
> 
>  Initial map will be calculated with pre-weighted amplitudes ...
>  CAD:  Error in label assignments in LKYSET
> 
> QUITTING ... ARP/wARP module stopped with an error message:
> CAD
> ++++++++++++++++++++++
> 
> The relvant CAD log file is also attached below
> 
> ++++++++++++++++++++++++
>  Chosen Asymmetric unit of reciprocal space:
>  [mmm] hkl:h>=0, k>=0, l>=0
> 
> 
>  ** "Missing" flag set in HKLIN1 to Nan:
> 
> 
>  ** "Missing" entries LISTED as           -999.000
>  Data line--- LABIN  E1=FBshasol E2
> MtzParseLabin: run out of labels trying to match "E2"
>  CAD:  Error in label assignments in LKYSET
> 
> ++++++++++++++++++++++
> 
> This happened on another dataset so I wanted to see whether the example 
> file runs ok.
> 
> Please help
> 
> Subbu
> 
> 
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