AMBER: check in leap

From: Gustavo Pierdominici Sottile <>
Date: Tue, 15 Feb 2005 16:34:21 -0300

   In the system I use, I have two non standard aminoacids. None of them
have a total integral charge. One of them has -0.11 and the other one just
the opposite so as to make then be a neutral group.
The question is: when I do check AMI (the non standard aminoacid) besides a
warning message, it also appears an error message saying that the charge of
the unit is not integral, is there any problem with this?
Thanks in advance

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Received on Tue Feb 15 2005 - 19:53:00 PST
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