Hi,
If I run with tleap, I don't have any problem.
$ tleap -f leap.in
..
With sleap, I get following errors.
$ sleap -f leap.in
...
Warning: there is an atom in residue WATA17 which does not exist in the
model 3!
This atom will not be created.
Warning: there is an atom in residue WATA18 which does not exist in the
model 3!
This atom will not be created.
Warning: there is an atom in residue WATA19 which does not exist in the
model 3!
This atom will not be created.
Warning: there is an atom in residue WATA20 which does not exist in the
model 3!
This atom will not be created.
Warning: there is an atom in residue WATA21 which does not exist in the
model 3!
This atom will not be created.
Warning: there is an atom in residue WATA22 which does not exist in the
model 3!
This atom will not be created.
Please try with the attached files.
--
Best,
InSuk Joung
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- application/octet-stream attachment: leap.in
Received on Thu Mar 04 2010 - 14:00:04 PST
