AMBER Archive (2009)

Subject: [AMBER] Request an error

From: Collins Nganou (nganoucollins_at_gmail.com)
Date: Thu Apr 30 2009 - 12:41:48 CDT

Dear Ross,

I am trying to run sander machine with the following input script that you
give us in : http://ambermd.org/tutorials/basic/tutorial1/

polyA-polyT 10-mer: initial minimization solvent + ions
 &cntrl
  imin = 1,
  maxcyc = 1000,

  ncyc = 500,
  ntb = 1,
  ntr = 1,
  cut = 10.0
 /
Hold the DNA fixed
500.0
RES 1 20
END
END

sander -O -i polyAT_wat_min1.in -o polyAT_wat_min1.out -p
polyAT_wat.prmtop -c polyAT_wat.inpcrd -r polyAT_wat_min1.rst -ref
polyAT_wat.inpcrd

I receive the following error:

At line 2206 of file _ew_setup.f
Fortran runtime error: Bad value during integer read

After open _ew_septup.f, I realise that this line 2206 didn't exist....(
The file is located in src/sander)...
I will be very grateful to receive all idea to go through this problem...

I am very apologize for this mail.....

I didn't have idea to solve it.

Best regards
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