Dear All,
I got the following error in the MM-PBSA calculation with amber10,
modeling a system of ~12,000 atoms.
[...]
Use of uninitialized value in multiplication (*) at
/home/bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1423.
Use of uninitialized value in multiplication (*) at
/home/bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1423.
Use of uninitialized value in multiplication (*) at
/home/bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1396.
Use of uninitialized value in multiplication (*) at
/home/bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1396.
Use of uninitialized value in multiplication (*) at
/home/bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1396.
Use of uninitialized value in multiplication (*) at
/home/bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1378.
Use of uninitialized value in multiplication (*) at
/home//bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1542.
Use of uninitialized value in multiplication (*) at
/home/bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1542.
Use of uninitialized value in multiplication (*) at
/home/bin/amber10/src/mm_pbsa/mm_pbsa_statistics.pm line 1542.
[...]
and I don't get the final results. The same script works
perfectly for a system of smaller dimension.
do you have any idea on the origin of this problem
and how to fix it?
thanks a lot
regards
claudio
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Received on Fri Oct 03 2008 - 05:07:53 PDT
