AMBER: antechamber problems

From: jani sahil <genomejani.gmail.com>
Date: Sat, 5 Jan 2008 09:19:10 +0530

Hello
   I got a problem when I try to produce ligand prep file using antechamber
in AMBER8.0
    The following is what I did
antechamber -i inb.pdb -fi pdb -o inb.prepin -fo prepi -c bcc -s 2

the following error I got
Warning: the assigned bond types may be wrong, please :
(1) double check the structure (the connectivity) and/or
(2) adjust atom valence penalty parameters in APS.DAT, and/or
(3) increase MAXVASTATE in define.h and recompile bondtype.C
(4) increase PSCUTOFF in define.h and recompile bondtype.C


I am attaching input file.

Can anyone tell me how to deal with it? Thank you in advance.
   Best regard,
 JANI VINOD


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Received on Sun Jan 06 2008 - 06:07:02 PST
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