[ccp4bb]: DM - NCS average

[Anil Kumar P <anilkp@physics.iisc.ernet.in>]

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Hi,

I am trying to use DM for NCS AVERaging. I hav 12 copies of a dimer in AU.
So, I am averaging the dimer unit.  When I execute the dm script, neither
it executes(CPU monitor shows no activity) nor it produces any error
message.  I have waited for more than 6-7 hrs. There must be catch in my
script for sure.. any pointers as what mistake i have done?  I would
appreciate your help.

hav a look at the script :
--------------------------------------------------------
#
# NON-CRYSTALLOGRAPHIC SYMMETRY AVERAGING WITH AUTOMASK
#[ A averaging calculation. No input averaging        ]
#[ mask is required, the the NCSMASK NMER keyword is  ]
#[ added. Mask is updated occasionally.               ]
#

dm   hklin an_cr2sigmaa.mtz hklout an_cr2dm.mtz 
     << MY-DATA
SOLC 0.51
NCSMASK NMER 12 UPDATE 4
NCYC 10
MODE SOLV HIST AVER
COMBINE PERT
AVER REFI
ROTA POLAR  0.0  0.0  0.0
TRANS  0.0  0.0  0.0
AVER REFI
ROTATE EULER 9.31703 118.07500  14.97913
TRANSLATE 32.33578  -7.74768  46.05556
AVER REFI
ROTATE EULER 164.34761 119.12077 170.83229
TRANSLATE  57.04405  -3.09500  -4.59729
AVER REFI
ROTATE EULER 163.90109 -56.65704  16.01099
TRANSLATE 37.42472  31.87961 -14.67980
AVER REFI
ROTATE EULER  8.53958 -66.21269 171.99561
TRANSLATE 56.60130  24.98391  38.29200
AVER REFI
ROTATE EULER  165.40738 -175.00908  -7.67949
TRANSLATE 0.80886  29.52817  28.53292
AVER REFI
ROTATE EULER 173.47414  59.58735 -170.79063
TRANSLATE  70.81509  -8.05054  74.53029
AVER REFI
ROTATE EULER  12.10064  60.76822  -3.55467
TRANSLATE 47.75955  -7.87001 125.98346
AVER REFI
ROTATE EULER 102.89784 174.60793 103.43655
TRANSLATE 104.76361  -5.45986 120.78203
AVER REFI
ROTATE EULER  62.28097  -6.94349 124.03066
TRANSLATE 103.13129  26.77161  94.44754
AVER REFI
ROTATE EULER  12.83137 -123.47861 -169.40572
TRANSLATE 67.73838  26.19091 138.78674
AVER REFI
ROTATE EULER  173.13881 -115.38959  -2.82774
TRANSLATE 47.80469  23.43495  85.50771
LABIN FP=F SIGFP=SIGF FREE=FreeR_flag PHIO=PHIC FOMO=WCMB
LABOUT PHIDM=PHIDM FOMDM=FOMDM
END
MY-DATA

----------------------------------------------

thanks,
Anil

  _____________________________________________________________________

   Anil Kumar P, Department of Physics, Indian Institute of Science,
   Bangalore - 560 012, INDIA  Phone:+91-80-3092718 FAX:+91-80-3601683
  _____________________________________________________________________