AMBER Archive (2007)

Subject: AMBER: Can't open PDB file in xleap

From: Vijay Manickam Achari (vjrajamany_at_yahoo.com)
Date: Mon Jul 16 2007 - 04:43:16 CDT

 
 [teohtc_at_glycomol02 Lyotropic]$ xleap -f vjbetaMal
 -I: Adding /home/cluster/app/amber7/dat/leap/prep to
 search path.
 -I: Adding /home/cluster/app/amber7/dat/leap/lib to
 search path.
 -I: Adding /home/cluster/app/amber7/dat/leap/parm to
 search path.
 -I: Adding /home/cluster/app/amber7/dat/leap/cmd to
 search path.
 -f: Source vjbetaMal.
 !FATAL ERROR----------------------------------------
 !FATAL: In file [chirality.c], line 116
 !FATAL: Message: No O22 in aaOrig list
 
 Can anyone there help me to solve this problem.
 It states chirality.c error in line 116...
 What is the meaning and how to solve this matter?
 
 Thank you.
 With regards
 Vijay
  

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