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[ccp4bb]: AMoRe



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Hi,

I had some problem using tabling in AMoRe.  Fowllowed
are the input file and error message.  Is there anyone
can tell me what is wrong?

INPUT
#    tabling run:
#   ##############
amore  xyzin1  ./model.pdb \
       xyzout1 ./temp/searchrot.pdb \
       TABLE1 ./temp/search.tab <<  eof
TITLE :  Produce table for MODEL FRAGMENT
TABFUN
CRYSTAL 168.15 168.15 151.35 90.00 90.00 90.00 ORTH 1 

MODEL 1 BREPLACE 0 BADD 0
SAMPLE 1 RESO 3.5 SHANN 2.5 SCALE 4.0
eof

OUTPUT
........
 FORMATTED      OLD     file opened on unit   7
 Logical name: XYZIN1, Full name: ./model.pdb

<!--SUMMARY_BEGIN-->

  $TEXT:Warning: $$ comment $$
  WARNING:  NO CRYST CARDS READ FROM XYZIN1
  $$
<!--SUMMARY_END-->
<!--SUMMARY_BEGIN-->

  $TEXT:Warning: $$ comment $$
  WARNING:  NO SCALE CARDS READ FROM XYZIN1
  $$
<!--SUMMARY_END-->

 FORMATTED      UNKNOWN file opened on unit   8
 Logical name: XYZOUT1, Full name:
.../temp/searchrot.pdb


 UNFORMATTED    UNKNOWN file opened on unit   1
 Logical name: TABLE1, Full name: ./temp/search.tab

 Open failed: Unit:   9, File:
/tmp/mary/amore_temp2.24968 (logical: TEMP2)
<!--SUMMARY_BEGIN-->
 Last system error message:
 No such file or directory
 AMORE:   Open failed: File:
/tmp/mary/amore_temp2.24968
 Times: User:       0.2s System:    1.3s Elapsed:   
0:02
<!--SUMMARY_END-->

Thank you in advance.


Mary



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